3-[[2-(4-methylphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoic acid

Systemtic Name: 3-[[2-(4-methylphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoic acid Openeye Name: 3-[[1,3-dioxo-2-(p-tolyl)isoindoline-5-carbonyl]amino]benzoic acid CAS Name: 3-[[[2-(4-methylphenyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[2-(4-methylphenyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid Traditional Name: 3-[[1,3-diketo-2-(p-tolyl)isoindoline-5-carbonyl]amino]benzoic acid Formula: C23H16N2O5 MolecularWeight: 400.38354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C23H16N2O5/c1-13-5-8-17(9-6-13)25-21(27)18-10-7-14(12-19(18)22(25)28)20(26)24-16-4-2-3-15(11-16)23(29)30/h2-12H,1H3,(H,24,26)(H,29,30)