(phenylmethyl) 2-(4-methoxy-2-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (phenylmethyl) 2-(4-methoxy-2-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: benzyl 2-(4-methoxy-2-nitro-phenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-methoxy-2-nitrophenyl)-1,3-dioxo-5-isoindolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(4-methoxy-2-nitrophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(4-methoxy-2-nitro-phenyl)isoindoline-5-carboxylic acid benzyl ester Formula: C23H16N2O7 MolecularWeight: 432.38234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H16N2O7/c1-31-16-8-10-19(20(12-16)25(29)30)24-21(26)17-9-7-15(11-18(17)22(24)27)23(28)32-13-14-5-3-2-4-6-14/h2-12H,13H2,1H3