disodium 2-[[3-(2-carboxylatophenyl)imino-2-phenyl-inden-1-yl]amino]benzoate hydrochloride

Systemtic Name: disodium 2-[[3-(2-carboxylatophenyl)imino-2-phenyl-inden-1-yl]amino]benzoate hydrochloride Openeye Name: disodium 2-[[3-(2-carboxylatophenyl)imino-2-phenyl-inden-1-yl]amino]benzoate hydrochloride CAS Name: disodium 2-[[3-(2-carboxylatophenyl)imino-2-phenyl-1-indenyl]amino]benzoate hydrochloride IUPAC Name: disodium 2-[[3-(2-carboxylatophenyl)imino-2-phenylinden-1-yl]amino]benzoate hydrochloride Traditional Name: disodium 2-[[3-(2-carboxylatophenyl)imino-2-phenyl-inden-1-yl]amino]benzoate hydrochloride Formula: C29H19ClN2Na2O4 MolecularWeight: 540.9047

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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-].[Na+].[Na+].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-].[Na+].[Na+].Cl

InChI

InChI=1S/C29H20N2O4.ClH.2Na/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;;/q;;2*+1/p-2