3-[[2-(3,4-dimethoxyphenyl)-3-oxidanylidene-inden-1-yl]amino]benzoic acid

Systemtic Name: 3-[[2-(3,4-dimethoxyphenyl)-3-oxidanylidene-inden-1-yl]amino]benzoic acid Openeye Name: 3-[[2-(3,4-dimethoxyphenyl)-3-oxo-inden-1-yl]amino]benzoic acid CAS Name: 3-[[2-(3,4-dimethoxyphenyl)-3-oxo-1-indenyl]amino]benzoic acid IUPAC Name: 3-[[2-(3,4-dimethoxyphenyl)-3-oxoinden-1-yl]amino]benzoic acid Traditional Name: 3-[[2-(3,4-dimethoxyphenyl)-3-keto-inden-1-yl]amino]benzoic acid Formula: C24H19NO5 MolecularWeight: 401.41136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)O)OC

InChI

InChI=1S/C24H19NO5/c1-29-19-11-10-14(13-20(19)30-2)21-22(17-8-3-4-9-18(17)23(21)26)25-16-7-5-6-15(12-16)24(27)28/h3-13,25H,1-2H3,(H,27,28)