(4-nitrophenyl) 2-(4-iodophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (4-nitrophenyl) 2-(4-iodophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (4-nitrophenyl) 2-(4-iodophenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-iodophenyl)-1,3-dioxo-5-isoindolecarboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-(4-iodophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-iodophenyl)-1,3-diketo-isoindoline-5-carboxylic acid (4-nitrophenyl) ester Formula: C21H11IN2O6 MolecularWeight: 514.22631

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-])I

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-])I

InChI

InChI=1S/C21H11IN2O6/c22-13-2-4-14(5-3-13)23-19(25)17-10-1-12(11-18(17)20(23)26)21(27)30-16-8-6-15(7-9-16)24(28)29/h1-11H