2-[(8-nitro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(8-nitro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(8-nitro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[(8-nitro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(8-nitro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(8-nitro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl)methyl]isoindoline-1,3-quinone Formula: C26H17N5O4 MolecularWeight: 463.44428

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=NC=C(N2C3=C(C=C(C=C3)[N+](=O)[O-])C(=N1)C4=CC=CC=C4)CN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1C2=NC=C(N2C3=C(C=C(C=C3)[N+](=O)[O-])C(=N1)C4=CC=CC=C4)CN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C26H17N5O4/c32-25-19-8-4-5-9-20(19)26(33)29(25)15-18-13-27-23-14-28-24(16-6-2-1-3-7-16)21-12-17(31(34)35)10-11-22(21)30(18)23/h1-13H,14-15H2