11-(3-piperidin-1-ylpropanoyl)-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride

Systemtic Name: 11-(3-piperidin-1-ylpropanoyl)-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Openeye Name: 11-[3-(1-piperidyl)propanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride CAS Name: 11-[1-oxo-3-(1-piperidinyl)propyl]-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride IUPAC Name: 11-(3-piperidin-1-ylpropanoyl)-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Traditional Name: 11-(3-piperidinopropanoyl)-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Formula: C21H24ClN3O2 MolecularWeight: 385.88716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC(=O)N2C3=CC=CC=C3C(=O)NC4=CC=CC=C42.Cl

Isomeric SMILES

C1CCN(CC1)CCC(=O)N2C3=CC=CC=C3C(=O)NC4=CC=CC=C42.Cl

InChI

InChI=1S/C21H23N3O2.ClH/c25-20(12-15-23-13-6-1-7-14-23)24-18-10-4-2-8-16(18)21(26)22-17-9-3-5-11-19(17)24;/h2-5,8-11H,1,6-7,12-15H2,(H,22,26);1H