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Details

Stereochemistry MIXED
Molecular Formula C19H23NO4
Molecular Weight 329.3902
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LABETALOL ACID

SMILES

CC(CCC1=CC=CC=C1)NCC(O)C2=CC=C(O)C(=C2)C(O)=O

InChI

InChIKey=DZBUYRWVQLOXQQ-UHFFFAOYSA-N
InChI=1S/C19H23NO4/c1-13(7-8-14-5-3-2-4-6-14)20-12-18(22)15-9-10-17(21)16(11-15)19(23)24/h2-6,9-11,13,18,20-22H,7-8,12H2,1H3,(H,23,24)

HIDE SMILES / InChI

Molecular Formula C19H23NO4
Molecular Weight 329.3902
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:07:29 GMT 2023
Edited
by admin
on Sat Dec 16 15:07:29 GMT 2023
Record UNII
3SUJ0U4ZMR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LABETALOL ACID
Common Name English
BENZOIC ACID, 2-HYDROXY-5-(1-HYDROXY-2-((1-METHYL-3-PHENYLPROPYL)AMINO)ETHYL)-
Systematic Name English
2-HYDROXY-5-(1-HYDROXY-2-((1-METHYL-3-PHENYLPROPYL)AMINO)ETHYL)BENZOIC ACID
Systematic Name English
LABETALOL-1-CARBOXYLIC ACID
Common Name English
LABETALOL HYDROCHLORIDE IMPURITY A [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
71749709
Created by admin on Sat Dec 16 15:07:29 GMT 2023 , Edited by admin on Sat Dec 16 15:07:29 GMT 2023
PRIMARY
CAS
1391051-99-2
Created by admin on Sat Dec 16 15:07:29 GMT 2023 , Edited by admin on Sat Dec 16 15:07:29 GMT 2023
PRIMARY
FDA UNII
3SUJ0U4ZMR
Created by admin on Sat Dec 16 15:07:29 GMT 2023 , Edited by admin on Sat Dec 16 15:07:29 GMT 2023
PRIMARY