2-[4-(1H-benzimidazol-2-yl)phenyl]-5-(3-nitrophenyl)carbonyl-isoindole-1,3-dione

Systemtic Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-5-(3-nitrophenyl)carbonyl-isoindole-1,3-dione Openeye Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-5-(3-nitrobenzoyl)isoindoline-1,3-dione CAS Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-5-[(3-nitrophenyl)-oxomethyl]isoindole-1,3-dione IUPAC Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-5-(3-nitrobenzoyl)isoindole-1,3-dione Traditional Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-5-(3-nitrobenzoyl)isoindoline-1,3-quinone Formula: C28H16N4O5 MolecularWeight: 488.45044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)C(=O)C6=CC(=CC=C6)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)C(=O)C6=CC(=CC=C6)[N+](=O)[O-]

InChI

InChI=1S/C28H16N4O5/c33-25(17-4-3-5-20(14-17)32(36)37)18-10-13-21-22(15-18)28(35)31(27(21)34)19-11-8-16(9-12-19)26-29-23-6-1-2-7-24(23)30-26/h1-15H,(H,29,30)