5-(3-nitrophenyl)carbonyl-2-(4-phenoxyphenyl)isoindole-1,3-dione

Systemtic Name: 5-(3-nitrophenyl)carbonyl-2-(4-phenoxyphenyl)isoindole-1,3-dione Openeye Name: 5-(3-nitrobenzoyl)-2-(4-phenoxyphenyl)isoindoline-1,3-dione CAS Name: 5-[(3-nitrophenyl)-oxomethyl]-2-(4-phenoxyphenyl)isoindole-1,3-dione IUPAC Name: 5-(3-nitrobenzoyl)-2-(4-phenoxyphenyl)isoindole-1,3-dione Traditional Name: 5-(3-nitrobenzoyl)-2-(4-phenoxyphenyl)isoindoline-1,3-quinone Formula: C27H16N2O6 MolecularWeight: 464.42574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H16N2O6/c30-25(17-5-4-6-20(15-17)29(33)34)18-9-14-23-24(16-18)27(32)28(26(23)31)19-10-12-22(13-11-19)35-21-7-2-1-3-8-21/h1-16H