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

Systemtic Name: 3-ethyl-2-methoxy-9-(3-methoxy-4-nitro-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Openeye Name: 3-ethyl-2-methoxy-9-(3-methoxy-4-nitro-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one CAS Name: 3-ethyl-2-methoxy-9-(3-methoxy-4-nitrophenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one IUPAC Name: 3-ethyl-2-methoxy-9-(3-methoxy-4-nitrophenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Traditional Name: 3-ethyl-2-methoxy-9-(3-methoxy-4-nitro-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Formula: C23H21N3O5 MolecularWeight: 419.42994

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1OC)NC3=C(C=CC(=C3)C4=CC(=C(C=C4)[N+](=O)[O-])OC)C(=O)N2

Isomeric SMILES

CCC1=CC2=C(C=C1OC)NC3=C(C=CC(=C3)C4=CC(=C(C=C4)[N+](=O)[O-])OC)C(=O)N2

InChI

InChI=1S/C23H21N3O5/c1-4-13-9-18-19(12-21(13)30-2)24-17-10-14(5-7-16(17)23(27)25-18)15-6-8-20(26(28)29)22(11-15)31-3/h5-12,24H,4H2,1-3H3,(H,25,27)