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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H24N2O3
Molecular Weight 328.4055
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LABETOLOL, (R,S)-

SMILES

C[C@@H](CCC1=CC=CC=C1)NC[C@H](O)C2=CC=C(O)C(=C2)C(N)=O

InChI

InChIKey=SGUAFYQXFOLMHL-UGSOOPFHSA-N
InChI=1S/C19H24N2O3/c1-13(7-8-14-5-3-2-4-6-14)21-12-18(23)15-9-10-17(22)16(11-15)19(20)24/h2-6,9-11,13,18,21-23H,7-8,12H2,1H3,(H2,20,24)/t13-,18-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H24N2O3
Molecular Weight 328.4055
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:54:38 GMT 2023
Edited
by admin
on Sat Dec 16 14:54:38 GMT 2023
Record UNII
GA3AWI2QBK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LABETOLOL, (R,S)-
Common Name English
(R,S)-LABETOLOL
Common Name English
BENZAMIDE, 2-HYDROXY-5-((1R)-1-HYDROXY-2-(((1S)-1-METHYL-3-PHENYLPROPYL)AMINO)ETHYL)-
Systematic Name English
2-HYDROXY-5-((1R)-1-HYDROXY-2-(((1S)-1-METHYL-3-PHENYLPROPYL)AMINO)ETHYL)BENZAMIDE
Systematic Name English
Code System Code Type Description
CAS
83167-31-1
Created by admin on Sat Dec 16 14:54:38 GMT 2023 , Edited by admin on Sat Dec 16 14:54:38 GMT 2023
PRIMARY
PUBCHEM
3046034
Created by admin on Sat Dec 16 14:54:38 GMT 2023 , Edited by admin on Sat Dec 16 14:54:38 GMT 2023
PRIMARY
FDA UNII
GA3AWI2QBK
Created by admin on Sat Dec 16 14:54:38 GMT 2023 , Edited by admin on Sat Dec 16 14:54:38 GMT 2023
PRIMARY