(3-nitrophenyl) 1,3-bis(oxidanylidene)-2-phenyl-isoindole-5-carboxylate

Systemtic Name: (3-nitrophenyl) 1,3-bis(oxidanylidene)-2-phenyl-isoindole-5-carboxylate Openeye Name: (3-nitrophenyl) 1,3-dioxo-2-phenyl-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-phenyl-5-isoindolecarboxylic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 1,3-dioxo-2-phenylisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-phenyl-isoindoline-5-carboxylic acid (3-nitrophenyl) ester Formula: C21H12N2O6 MolecularWeight: 388.32978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H12N2O6/c24-19-17-10-9-13(21(26)29-16-8-4-7-15(12-16)23(27)28)11-18(17)20(25)22(19)14-5-2-1-3-6-14/h1-12H