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

Systemtic Name: 2-(2-hydroxyethyloxy)-3-methoxy-9-(3-methoxy-4-nitro-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Openeye Name: 2-(2-hydroxyethoxy)-3-methoxy-9-(3-methoxy-4-nitro-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one CAS Name: 2-(2-hydroxyethoxy)-3-methoxy-9-(3-methoxy-4-nitrophenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one IUPAC Name: 2-(2-hydroxyethoxy)-3-methoxy-9-(3-methoxy-4-nitrophenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Traditional Name: 2-(2-hydroxyethoxy)-3-methoxy-9-(3-methoxy-4-nitro-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Formula: C23H21N3O7 MolecularWeight: 451.42874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC3=C(C=C2)C(=O)NC4=CC(=C(C=C4N3)OCCO)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC3=C(C=C2)C(=O)NC4=CC(=C(C=C4N3)OCCO)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O7/c1-31-20-10-14(4-6-19(20)26(29)30)13-3-5-15-16(9-13)24-17-12-22(33-8-7-27)21(32-2)11-18(17)25-23(15)28/h3-6,9-12,24,27H,7-8H2,1-2H3,(H,25,28)