6-pyridin-3-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 6-pyridin-3-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one Openeye Name: 6-(3-pyridyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one CAS Name: 6-(3-pyridinyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one IUPAC Name: 6-pyridin-3-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one Traditional Name: 6-(3-pyridyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one Formula: C18H17N3O MolecularWeight: 291.34708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(NC3=CC=CC=C3N2)C4=CN=CC=C4)C(=O)C1

Isomeric SMILES

C1CC2=C(C(NC3=CC=CC=C3N2)C4=CN=CC=C4)C(=O)C1

InChI

InChI=1S/C18H17N3O/c22-16-9-3-8-15-17(16)18(12-5-4-10-19-11-12)21-14-7-2-1-6-13(14)20-15/h1-2,4-7,10-11,18,20-21H,3,8-9H2