2-[[2-[(2-carboxyphenyl)amino]phenyl]amino]-5-cyano-benzoic acid

Systemtic Name: 2-[[2-[(2-carboxyphenyl)amino]phenyl]amino]-5-cyano-benzoic acid Openeye Name: 2-[2-(2-carboxyanilino)anilino]-5-cyano-benzoic acid CAS Name: 2-[2-(2-carboxyanilino)anilino]-5-cyanobenzoic acid IUPAC Name: 2-[2-(2-carboxyanilino)anilino]-5-cyanobenzoic acid Traditional Name: 2-[2-(2-carboxyanilino)anilino]-5-cyano-benzoic acid Formula: C21H15N3O4 MolecularWeight: 373.3615

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC=C2NC3=C(C=C(C=C3)C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC=C2NC3=C(C=C(C=C3)C#N)C(=O)O

InChI

InChI=1S/C21H15N3O4/c22-12-13-9-10-17(15(11-13)21(27)28)24-19-8-4-3-7-18(19)23-16-6-2-1-5-14(16)20(25)26/h1-11,23-24H,(H,25,26)(H,27,28)