4-[[3-(4-carboxy-4-methyl-cyclohexa-1,5-dien-1-yl)imino-2-phenyl-inden-1-yl]amino]benzoic acid

Systemtic Name: 4-[[3-(4-carboxy-4-methyl-cyclohexa-1,5-dien-1-yl)imino-2-phenyl-inden-1-yl]amino]benzoic acid Openeye Name: 4-[[3-(4-carboxy-4-methyl-cyclohexa-1,5-dien-1-yl)imino-2-phenyl-inden-1-yl]amino]benzoic acid CAS Name: 4-[[3-[(4-carboxy-4-methyl-1-cyclohexa-1,5-dienyl)imino]-2-phenyl-1-indenyl]amino]benzoic acid IUPAC Name: 4-[[3-(4-carboxy-4-methylcyclohexa-1,5-dien-1-yl)imino-2-phenylinden-1-yl]amino]benzoic acid Traditional Name: 4-[[3-(4-carboxy-4-methyl-cyclohexa-1,5-dien-1-yl)imino-2-phenyl-inden-1-yl]amino]benzoic acid Formula: C30H24N2O4 MolecularWeight: 476.52256

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C=C1)N=C2C3=CC=CC=C3C(=C2C4=CC=CC=C4)NC5=CC=C(C=C5)C(=O)O)C(=O)O

Isomeric SMILES

CC1(CC=C(C=C1)N=C2C3=CC=CC=C3C(=C2C4=CC=CC=C4)NC5=CC=C(C=C5)C(=O)O)C(=O)O

InChI

InChI=1S/C30H24N2O4/c1-30(29(35)36)17-15-22(16-18-30)32-27-24-10-6-5-9-23(24)26(25(27)19-7-3-2-4-8-19)31-21-13-11-20(12-14-21)28(33)34/h2-17,31H,18H2,1H3,(H,33,34)(H,35,36)