dimethyl 5-[[3-oxidanylidene-2-(phenylmethyl)-1H-isoindol-1-yl]amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[3-oxidanylidene-2-(phenylmethyl)-1H-isoindol-1-yl]amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(2-benzyl-3-oxo-isoindolin-1-yl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[3-oxo-2-(phenylmethyl)-1H-isoindol-1-yl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(2-benzyl-3-oxo-1H-isoindol-1-yl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(2-benzyl-3-keto-isoindolin-1-yl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C25H22N2O5 MolecularWeight: 430.45258

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC2C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC2C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H22N2O5/c1-31-24(29)17-12-18(25(30)32-2)14-19(13-17)26-22-20-10-6-7-11-21(20)23(28)27(22)15-16-8-4-3-5-9-16/h3-14,22,26H,15H2,1-2H3