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Details

Stereochemistry RACEMIC
Molecular Formula C18H31NO4.ClH
Molecular Weight 361.904
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BISOPROLOL HYDROCHLORIDE

SMILES

Cl.CC(C)NCC(O)COC1=CC=C(COCCOC(C)C)C=C1

InChI

InChIKey=NDIJCSDPVYWQSZ-UHFFFAOYSA-N
InChI=1S/C18H31NO4.ClH/c1-14(2)19-11-17(20)13-23-18-7-5-16(6-8-18)12-21-9-10-22-15(3)4;/h5-8,14-15,17,19-20H,9-13H2,1-4H3;1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H31NO4
Molecular Weight 325.443
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 22:00:33 UTC 2023
Edited
by admin
on Fri Dec 15 22:00:33 UTC 2023
Record UNII
2EX58570NP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BISOPROLOL HYDROCHLORIDE
Common Name English
2-PROPANOL, 1-(4-((2-(1-METHYLETHOXY)ETHOXY)METHYL)PHENOXY)-3-((1-METHYLETHYL)AMINO)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
SMS_ID
100000168458
Created by admin on Fri Dec 15 22:00:34 UTC 2023 , Edited by admin on Fri Dec 15 22:00:34 UTC 2023
PRIMARY
PUBCHEM
68525101
Created by admin on Fri Dec 15 22:00:34 UTC 2023 , Edited by admin on Fri Dec 15 22:00:34 UTC 2023
PRIMARY
CAS
85532-43-0
Created by admin on Fri Dec 15 22:00:34 UTC 2023 , Edited by admin on Fri Dec 15 22:00:34 UTC 2023
PRIMARY
EVMPD
SUB181841
Created by admin on Fri Dec 15 22:00:34 UTC 2023 , Edited by admin on Fri Dec 15 22:00:34 UTC 2023
PRIMARY
FDA UNII
2EX58570NP
Created by admin on Fri Dec 15 22:00:34 UTC 2023 , Edited by admin on Fri Dec 15 22:00:34 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE