2-[[2-(2,4-dimethylphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoate

Systemtic Name: 2-[[2-(2,4-dimethylphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoate Openeye Name: 2-[[2-(2,4-dimethylphenyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]benzoate CAS Name: 2-[[[2-(2,4-dimethylphenyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]benzoate IUPAC Name: 2-[[2-(2,4-dimethylphenyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoate Traditional Name: 2-[[2-(2,4-dimethylphenyl)-1,3-diketo-isoindoline-5-carbonyl]amino]benzoate Formula: C24H17N2O5- MolecularWeight: 413.40218

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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=C4C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=CC=C4C(=O)[O-])C

InChI

InChI=1S/C24H18N2O5/c1-13-7-10-20(14(2)11-13)26-22(28)16-9-8-15(12-18(16)23(26)29)21(27)25-19-6-4-3-5-17(19)24(30)31/h3-12H,1-2H3,(H,25,27)(H,30,31)/p-1