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Details

Stereochemistry RACEMIC
Molecular Formula C16H23NO2.ClH
Molecular Weight 297.82
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUFURALOL HYDROCHLORIDE

SMILES

Cl.CCC1=C2OC(=CC2=CC=C1)C(O)CNC(C)(C)C

InChI

InChIKey=KJBONRGCLLBWCJ-UHFFFAOYSA-N
InChI=1S/C16H23NO2.ClH/c1-5-11-7-6-8-12-9-14(19-15(11)12)13(18)10-17-16(2,3)4;/h6-9,13,17-18H,5,10H2,1-4H3;1H

HIDE SMILES / InChI

Molecular Formula C16H23NO2
Molecular Weight 261.3593
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:47:18 UTC 2023
Edited
by admin
on Fri Dec 15 15:47:18 UTC 2023
Record UNII
G66IY7Q7S4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUFURALOL HYDROCHLORIDE
MART.   MI   WHO-DD  
Common Name English
BUFURALOL HCL
Common Name English
ANGIUM
Brand Name English
RO-3-4787
Code English
2-BENZOFURANMETHANOL, .ALPHA.,-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-7-ETHYL-, HYDROCHLORIDE, (±)-
Common Name English
Bufuralol hydrochloride [WHO-DD]
Common Name English
BUFURALOL HYDROCHLORIDE [MART.]
Common Name English
RO-3-4787 HYDROCHLORIDE
Code English
2-BENZOFURANMETHANOL, .ALPHA.-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-7-ETHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
RO 3-4787 HYDROCHLORIDE
Code English
BUFURALOL HYDROCHLORIDE [MI]
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID50975052
Created by admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
PRIMARY
FDA UNII
G66IY7Q7S4
Created by admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
PRIMARY
ECHA (EC/EINECS)
262-216-3
Created by admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
PRIMARY
CAS
59652-29-8
Created by admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
SUPERSEDED
SMS_ID
100000084831
Created by admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
PRIMARY
PUBCHEM
151573
Created by admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
PRIMARY
DRUG BANK
DBSALT002370
Created by admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
PRIMARY
MERCK INDEX
m2755
Created by admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
PRIMARY Merck Index
EVMPD
SUB00893MIG
Created by admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
PRIMARY
CAS
60398-91-6
Created by admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
PRIMARY
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ACTIVE MOIETY