3-(3-hydroxyphenyl)-9-(3-methoxy-4-oxidanyl-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 3-(3-hydroxyphenyl)-9-(3-methoxy-4-oxidanyl-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Openeye Name: 9-(4-hydroxy-3-methoxy-phenyl)-3-(3-hydroxyphenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one CAS Name: 9-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxyphenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one IUPAC Name: 9-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxyphenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Traditional Name: 9-(4-hydroxy-3-methoxy-phenyl)-3-(3-hydroxyphenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Formula: C26H20N2O4 MolecularWeight: 424.448

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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(=CC=C5)O)O

Isomeric SMILES

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

InChI

InChI=1S/C26H20N2O4/c1-32-25-14-18(7-10-24(25)30)16-5-8-20-22(12-16)27-21-9-6-17(13-23(21)28-26(20)31)15-3-2-4-19(29)11-15/h2-14,27,29-30H,1H3,(H,28,31)