2-[[2-[(2-carboxyphenyl)amino]-3-methyl-phenyl]amino]benzoic acid

Systemtic Name: 2-[[2-[(2-carboxyphenyl)amino]-3-methyl-phenyl]amino]benzoic acid Openeye Name: 2-[2-(2-carboxyanilino)-3-methyl-anilino]benzoic acid CAS Name: 2-[2-(2-carboxyanilino)-3-methylanilino]benzoic acid IUPAC Name: 2-[2-(2-carboxyanilino)-3-methylanilino]benzoic acid Traditional Name: 2-[2-(2-carboxyanilino)-3-methyl-anilino]benzoic acid Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C21H18N2O4/c1-13-7-6-12-18(22-16-10-4-2-8-14(16)20(24)25)19(13)23-17-11-5-3-9-15(17)21(26)27/h2-12,22-23H,1H3,(H,24,25)(H,26,27)