2-[[3-(2-carboxyphenyl)imino-2-phenyl-inden-1-yl]amino]benzoic acid hydrochloride

Systemtic Name: 2-[[3-(2-carboxyphenyl)imino-2-phenyl-inden-1-yl]amino]benzoic acid hydrochloride Openeye Name: 2-[[3-(2-carboxyphenyl)imino-2-phenyl-inden-1-yl]amino]benzoic acid hydrochloride CAS Name: 2-[[3-(2-carboxyphenyl)imino-2-phenyl-1-indenyl]amino]benzoic acid hydrochloride IUPAC Name: 2-[[3-(2-carboxyphenyl)imino-2-phenylinden-1-yl]amino]benzoic acid hydrochloride Traditional Name: 2-[[3-(2-carboxyphenyl)imino-2-phenyl-inden-1-yl]amino]benzoic acid hydrochloride Formula: C29H21ClN2O4 MolecularWeight: 496.94104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=NC4=CC=CC=C4C(=O)O)NC5=CC=CC=C5C(=O)O.Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=NC4=CC=CC=C4C(=O)O)NC5=CC=CC=C5C(=O)O.Cl

InChI

InChI=1S/C29H20N2O4.ClH/c32-28(33)21-14-6-8-16-23(21)30-26-19-12-4-5-13-20(19)27(25(26)18-10-2-1-3-11-18)31-24-17-9-7-15-22(24)29(34)35;/h1-17,30H,(H,32,33)(H,34,35);1H