1-[11-methyl-6-(1-methylpiperidin-4-yl)benzo[b][1,4]benzodiazepin-3-yl]ethanone

Systemtic Name: 1-[11-methyl-6-(1-methylpiperidin-4-yl)benzo[b][1,4]benzodiazepin-3-yl]ethanone Openeye Name: 1-[11-methyl-6-(1-methyl-4-piperidyl)benzo[b][1,4]benzodiazepin-3-yl]ethanone CAS Name: 1-[11-methyl-6-(1-methyl-4-piperidinyl)-3-benzo[b][1,4]benzodiazepinyl]ethanone IUPAC Name: 1-[11-methyl-6-(1-methylpiperidin-4-yl)benzo[b][1,4]benzodiazepin-3-yl]ethanone Traditional Name: 1-[11-methyl-6-(1-methyl-4-piperidyl)benzo[b][1,4]benzodiazepin-3-yl]ethanone Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)N(C3=CC=CC=C3C(=N2)C4CCN(CC4)C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)N(C3=CC=CC=C3C(=N2)C4CCN(CC4)C)C

InChI

InChI=1S/C22H25N3O/c1-15(26)17-8-9-21-19(14-17)23-22(16-10-12-24(2)13-11-16)18-6-4-5-7-20(18)25(21)3/h4-9,14,16H,10-13H2,1-3H3