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

Systemtic Name: methyl 3-[[1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindol-5-yl]carbonylamino]benzoate Openeye Name: methyl 3-[(2-benzyl-1,3-dioxo-isoindoline-5-carbonyl)amino]benzoate CAS Name: 3-[[[1,3-dioxo-2-(phenylmethyl)-5-isoindolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(2-benzyl-1,3-dioxoisoindole-5-carbonyl)amino]benzoate Traditional Name: 3-[(2-benzyl-1,3-diketo-isoindoline-5-carbonyl)amino]benzoic acid methyl ester Formula: C24H18N2O5 MolecularWeight: 414.41012

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H18N2O5/c1-31-24(30)17-8-5-9-18(12-17)25-21(27)16-10-11-19-20(13-16)23(29)26(22(19)28)14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H,25,27)