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Details

Stereochemistry RACEMIC
Molecular Formula C16H25NO4
Molecular Weight 295.374
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ESMOLOL

SMILES

COC(=O)CCC1=CC=C(OCC(O)CNC(C)C)C=C1

InChI

InChIKey=AQNDDEOPVVGCPG-UHFFFAOYSA-N
InChI=1S/C16H25NO4/c1-12(2)17-10-14(18)11-21-15-7-4-13(5-8-15)6-9-16(19)20-3/h4-5,7-8,12,14,17-18H,6,9-11H2,1-3H3

HIDE SMILES / InChI
Molecular Formula C16H25NO4
Molecular Weight 295.374
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:30:38 UTC 2023
Edited
by admin
on Fri Dec 15 15:30:38 UTC 2023
Record UNII
MDY902UXSR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ESMOLOL
INN   MI   VANDF   WHO-DD  
INN  
Official Name English
ESMOLOL [MI]
Common Name English
(±)-METHYL P-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)HYDROCINNAMATE
Common Name English
ESMOLOL [VANDF]
Common Name English
ASL-8052-001
Code English
3-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)PROPIONIC ACID METHYL ESTER
Systematic Name English
BENZENEPROPANOIC ACID, 4-(2-HYDROXY-3-((1-METHYLETHYL)AMINO)PROPOXY)-, METHYL ESTER, (±)-
Common Name English
esmolol [INN]
Common Name English
Esmolol [WHO-DD]
Common Name English
BENZENEPROPANOIC ACID, 4-(2-HYDROXY-3-((1-METHYLETHYL)AMINO)PROPOXY)-, METHYL ESTER
Systematic Name English
(±)-ESMOLOL
Common Name English
Classification Tree Code System Code
NDF-RT N0000000161
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
WHO-VATC QC07AB09
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
NCI_THESAURUS C29576
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
WHO-ATC C07AB09
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
NDF-RT N0000175556
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
Code System Code Type Description
SMS_ID
100000078960
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
LACTMED
Esmolol
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
FDA UNII
MDY902UXSR
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
ChEMBL
CHEMBL768
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
CAS
103598-03-4
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
SUPERSEDED
DRUG CENTRAL
1054
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
WIKIPEDIA
ESMOLOL
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
IUPHAR
7178
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
NCI_THESAURUS
C72617
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
CAS
84057-94-3
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
SUPERSEDED
RXCUI
49737
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY RxNorm
DAILYMED
MDY902UXSR
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
INN
5365
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
EPA CompTox
DTXSID4022995
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
PUBCHEM
59768
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
DRUG BANK
DB00187
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
EVMPD
SUB13718MIG
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
MERCK INDEX
m5025
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY Merck Index
MESH
C036604
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
CHEBI
4856
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
CAS
81147-92-4
Created by admin on Fri Dec 15 15:30:38 UTC 2023 , Edited by admin on Fri Dec 15 15:30:38 UTC 2023
PRIMARY
Related Record Type Details
Structure of ESMOLOL, (R)-
ENANTIOMER -> RACEMATE
Structure of ESMOLOL HYDROCHLORIDE
SALT/SOLVATE -> PARENT
BETA-1 ADRENERGIC RECEPTOR
TARGET -> AGONIST
SHORT-ACTING
Structure of ESMOLOL SULFATE
SALT/SOLVATE -> PARENT
Structure of ESMOLOL, (S)-
ENANTIOMER -> RACEMATE
Related Record Type Details
Structure of BENZENEPROPANOIC ACID, 4,4'-(((1-METHYLETHYL)IMINO)BIS((2-HYDROXY-3,1-PROPANEDIYL)OXY))BIS-, DIMETHYL ESTER
IMPURITY -> PARENT
Related Record Type Details
Structure of ESMOLOL
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