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

Systemtic Name: 2-azanyl-9-(4-azanyl-3-methoxy-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Openeye Name: 2-amino-9-(4-amino-3-methoxy-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one CAS Name: 2-amino-9-(4-amino-3-methoxyphenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one IUPAC Name: 2-amino-9-(4-amino-3-methoxyphenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Traditional Name: 2-amino-9-(4-amino-3-methoxy-phenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Formula: C20H18N4O2 MolecularWeight: 346.38252

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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=C(C=C4)N)N

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O2/c1-26-19-9-12(3-6-15(19)22)11-2-5-14-17(8-11)23-18-10-13(21)4-7-16(18)24-20(14)25/h2-10,23H,21-22H2,1H3,(H,24,25)