9-(4-azanyl-3-methoxy-phenyl)-1-(pyridin-4-ylmethoxy)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 9-(4-azanyl-3-methoxy-phenyl)-1-(pyridin-4-ylmethoxy)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Openeye Name: 9-(4-amino-3-methoxy-phenyl)-1-(4-pyridylmethoxy)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one CAS Name: 9-(4-amino-3-methoxyphenyl)-1-(pyridin-4-ylmethoxy)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one IUPAC Name: 9-(4-amino-3-methoxyphenyl)-1-(pyridin-4-ylmethoxy)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Traditional Name: 9-(4-amino-3-methoxy-phenyl)-1-(4-pyridylmethoxy)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Formula: C26H22N4O3 MolecularWeight: 438.47788

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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)OCC5=CC=NC=C5)N

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC3=C(C=C2)C(=O)NC4=C(N3)C(=CC=C4)OCC5=CC=NC=C5)N

InChI

InChI=1S/C26H22N4O3/c1-32-24-14-18(6-8-20(24)27)17-5-7-19-22(13-17)29-25-21(30-26(19)31)3-2-4-23(25)33-15-16-9-11-28-12-10-16/h2-14,29H,15,27H2,1H3,(H,30,31)