9-(3-methoxy-4-nitro-phenyl)-3-(1H-pyrrol-2-yl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 9-(3-methoxy-4-nitro-phenyl)-3-(1H-pyrrol-2-yl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Openeye Name: 9-(3-methoxy-4-nitro-phenyl)-3-(1H-pyrrol-2-yl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one CAS Name: 9-(3-methoxy-4-nitrophenyl)-3-(1H-pyrrol-2-yl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one IUPAC Name: 9-(3-methoxy-4-nitrophenyl)-3-(1H-pyrrol-2-yl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Traditional Name: 9-(3-methoxy-4-nitro-phenyl)-3-(1H-pyrrol-2-yl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Formula: C24H18N4O4 MolecularWeight: 426.42412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC3=C(C=C2)C(=O)NC4=C(N3)C=CC(=C4)C5=CC=CN5)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC3=C(C=C2)C(=O)NC4=C(N3)C=CC(=C4)C5=CC=CN5)[N+](=O)[O-]

InChI

InChI=1S/C24H18N4O4/c1-32-23-13-15(6-9-22(23)28(30)31)14-4-7-17-20(11-14)26-19-8-5-16(18-3-2-10-25-18)12-21(19)27-24(17)29/h2-13,25-26H,1H3,(H,27,29)