4?-Chlorotartranilic acid, (S,S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C10H10ClNO5
Molecular Weight	259.643
Optical Activity	( - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4?-Chlorotartranilic acid, (S,S)-

Structure Search

SMILES

O[C@@H]([C@H](O)C(=O)NC1=CC=C(Cl)C=C1)C(O)=O

InChI

InChIKey=JLBJYGCSAOHRPK-YUMQZZPRSA-N

InChI=1S/C10H10ClNO5/c11-5-1-3-6(4-2-5)12-9(15)7(13)8(14)10(16)17/h1-4,7-8,13-14H,(H,12,15)(H,16,17)/t7-,8-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C10H10ClNO5
Molecular Weight	259.643
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 `Wed Apr 02 20:23:04 GMT 2025` Edited by `admin` on `Wed Apr 02 20:23:04 GMT 2025`
Record UNII	2R6DLJ5CEB
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4?-Chlorotartranilic acid, (S,S)-

Common Name

English

(-)-4'-Chlorotartranilic acid

Preferred Name

English

Butanoic acid, 4-[(4-chlorophenyl)amino]-2,3-dihydroxy-4-oxo-, (2S,3S)-

Systematic Name

English

(S,S)-4?-Chlorotartranilic acid

Common Name

English

(2S,3S)-4-[(4-Chlorophenyl)amino]-2,3-dihydroxy-4-oxobutanoic acid

Systematic Name

English

Butanoic acid, 4-[(4-chlorophenyl)amino]-2,3-dihydroxy-4-oxo-, [S-(R*,R*)]-

Systematic Name

English

Code System Code Type Description

FDA UNII

2R6DLJ5CEB

Created by admin on Wed Apr 02 20:23:04 GMT 2025 , Edited by admin on Wed Apr 02 20:23:04 GMT 2025

PRIMARY

CAS

46834-56-4

Created by admin on Wed Apr 02 20:23:04 GMT 2025 , Edited by admin on Wed Apr 02 20:23:04 GMT 2025

PRIMARY

PUBCHEM

14270103

Created by admin on Wed Apr 02 20:23:04 GMT 2025 , Edited by admin on Wed Apr 02 20:23:04 GMT 2025

PRIMARY

Related Record Type Details


					76D9XXV7PK

4?-Chlorotartranilic acid, (R,R)-rel-

RACEMATE -> ENANTIOMER

Amount: