11-[3-(azepan-1-yl)propyl]-5-methyl-pyrido[2,3-b][1,4]benzodiazepin-6-one

Systemtic Name: 11-[3-(azepan-1-yl)propyl]-5-methyl-pyrido[2,3-b][1,4]benzodiazepin-6-one Openeye Name: 11-[3-(azepan-1-yl)propyl]-5-methyl-pyrido[2,3-b][1,4]benzodiazepin-6-one CAS Name: 11-[3-(1-azepanyl)propyl]-5-methyl-6-pyrido[2,3-b][1,4]benzodiazepinone IUPAC Name: 11-[3-(azepan-1-yl)propyl]-5-methylpyrido[2,3-b][1,4]benzodiazepin-6-one Traditional Name: 11-[3-(azepan-1-yl)propyl]-5-methyl-pyrido[2,3-b][1,4]benzodiazepin-6-one Formula: C22H28N4O MolecularWeight: 364.48392

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=CC=C2)N(C3=CC=CC=C3C1=O)CCCN4CCCCCC4

Isomeric SMILES

CN1C2=C(N=CC=C2)N(C3=CC=CC=C3C1=O)CCCN4CCCCCC4

InChI

InChI=1S/C22H28N4O/c1-24-20-12-8-13-23-21(20)26(19-11-5-4-10-18(19)22(24)27)17-9-16-25-14-6-2-3-7-15-25/h4-5,8,10-13H,2-3,6-7,9,14-17H2,1H3