5-[[4-[[4-[(3-Carboxy-4-chlorophenyl)amino]phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]amino]-2-chlorobenzoic acid

Details

Stereochemistry	ACHIRAL
Molecular Formula	C33H22Cl2N2O4
Molecular Weight	581.445
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-[[4-[[4-[(3-Carboxy-4-chlorophenyl)amino]phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]amino]-2-chlorobenzoic acid

Structure Search

SMILES

OC(=O)C1=CC(NC2=CC=C(C=C2)C(C3=CC=CC=C3)=C4C=CC(C=C4)=NC5=CC(C(O)=O)=C(Cl)C=C5)=CC=C1Cl

InChI

InChIKey=JPOAXWSMFOLMQH-CKHAIHRBSA-N

InChI=1S/C33H22Cl2N2O4/c34-29-16-14-25(18-27(29)32(38)39)36-23-10-6-21(7-11-23)31(20-4-2-1-3-5-20)22-8-12-24(13-9-22)37-26-15-17-30(35)28(19-26)33(40)41/h1-19,36H,(H,38,39)(H,40,41)/b31-22-,37-24-

HIDE SMILES / InChI

Approval Year

Name

Type

Language

5-[[4-[[4-[(3-Carboxy-4-chlorophenyl)amino]phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]amino]-2-chlorobenzoic acid

Systematic Name

English

NSC-117907

Preferred Name

English

Benzoic acid, 5-[[4-[[4-[(3-carboxy-4-chlorophenyl)amino]phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]amino]-2-chloro-

Systematic Name

English

NCI-0117907a

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID701104561