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

Systemtic Name: 2-methoxy-9-(3-methoxy-4-nitro-phenyl)-3-(3-oxidanylpropyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Openeye Name: 3-(3-hydroxypropyl)-2-methoxy-9-(3-methoxy-4-nitro-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one CAS Name: 3-(3-hydroxypropyl)-2-methoxy-9-(3-methoxy-4-nitrophenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one IUPAC Name: 3-(3-hydroxypropyl)-2-methoxy-9-(3-methoxy-4-nitrophenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Traditional Name: 3-(3-hydroxypropyl)-2-methoxy-9-(3-methoxy-4-nitro-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Formula: C24H23N3O6 MolecularWeight: 449.45592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1CCCO)NC(=O)C3=C(N2)C=C(C=C3)C4=CC(=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC2=C(C=C1CCCO)NC(=O)C3=C(N2)C=C(C=C3)C4=CC(=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C24H23N3O6/c1-32-22-13-20-19(11-16(22)4-3-9-28)26-24(29)17-7-5-14(10-18(17)25-20)15-6-8-21(27(30)31)23(12-15)33-2/h5-8,10-13,25,28H,3-4,9H2,1-2H3,(H,26,29)