2,2-dimethyl-6-pyridin-3-yl-3,5,6,11-tetrahydro-1H-benzo[b][1,4]benzodiazepin-4-one

Systemtic Name: 2,2-dimethyl-6-pyridin-3-yl-3,5,6,11-tetrahydro-1H-benzo[b][1,4]benzodiazepin-4-one Openeye Name: 2,2-dimethyl-6-(3-pyridyl)-3,5,6,11-tetrahydro-1H-benzo[b][1,4]benzodiazepin-4-one CAS Name: 2,2-dimethyl-6-(3-pyridinyl)-3,5,6,11-tetrahydro-1H-benzo[b][1,4]benzodiazepin-4-one IUPAC Name: 2,2-dimethyl-6-pyridin-3-yl-3,5,6,11-tetrahydro-1H-benzo[b][1,4]benzodiazepin-4-one Traditional Name: 2,2-dimethyl-6-(3-pyridyl)-3,5,6,11-tetrahydro-1H-benzo[b][1,4]benzodiazepin-4-one Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)NC(C3=CC=CC=C3N2)C4=CN=CC=C4)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)NC(C3=CC=CC=C3N2)C4=CN=CC=C4)C

InChI

InChI=1S/C20H21N3O/c1-20(2)10-16-19(17(24)11-20)23-18(13-6-5-9-21-12-13)14-7-3-4-8-15(14)22-16/h3-9,12,18,22-23H,10-11H2,1-2H3