5-methyl-11-(3-piperidin-1-ylpropyl)pyrido[2,3-b][1,4]benzodiazepin-6-one hydrochloride

Systemtic Name: 5-methyl-11-(3-piperidin-1-ylpropyl)pyrido[2,3-b][1,4]benzodiazepin-6-one hydrochloride Openeye Name: 5-methyl-11-[3-(1-piperidyl)propyl]pyrido[2,3-b][1,4]benzodiazepin-6-one hydrochloride CAS Name: 5-methyl-11-[3-(1-piperidinyl)propyl]-6-pyrido[2,3-b][1,4]benzodiazepinone hydrochloride IUPAC Name: 5-methyl-11-(3-piperidin-1-ylpropyl)pyrido[2,3-b][1,4]benzodiazepin-6-one hydrochloride Traditional Name: 5-methyl-11-(3-piperidinopropyl)pyrido[2,3-b][1,4]benzodiazepin-6-one hydrochloride Formula: C21H27ClN4O MolecularWeight: 386.91828

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=CC=C2)N(C3=CC=CC=C3C1=O)CCCN4CCCCC4.Cl

Isomeric SMILES

CN1C2=C(N=CC=C2)N(C3=CC=CC=C3C1=O)CCCN4CCCCC4.Cl

InChI

InChI=1S/C21H26N4O.ClH/c1-23-19-11-7-12-22-20(19)25(16-8-15-24-13-5-2-6-14-24)18-10-4-3-9-17(18)21(23)26;/h3-4,7,9-12H,2,5-6,8,13-16H2,1H3;1H