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

Systemtic Name: 5-methyl-11-(3-pyrrolidin-1-ylpropanoyl)benzo[b][1,4]benzodiazepin-6-one hydrochloride Openeye Name: 5-methyl-11-(3-pyrrolidin-1-ylpropanoyl)benzo[b][1,4]benzodiazepin-6-one hydrochloride CAS Name: 5-methyl-11-[1-oxo-3-(1-pyrrolidinyl)propyl]-6-benzo[b][1,4]benzodiazepinone hydrochloride IUPAC Name: 5-methyl-11-(3-pyrrolidin-1-ylpropanoyl)benzo[b][1,4]benzodiazepin-6-one hydrochloride Traditional Name: 5-methyl-11-(3-pyrrolidinopropanoyl)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:

CN1C2=CC=CC=C2N(C3=CC=CC=C3C1=O)C(=O)CCN4CCCC4.Cl

Isomeric SMILES

CN1C2=CC=CC=C2N(C3=CC=CC=C3C1=O)C(=O)CCN4CCCC4.Cl

InChI

InChI=1S/C21H23N3O2.ClH/c1-22-18-10-4-5-11-19(18)24(17-9-3-2-8-16(17)21(22)26)20(25)12-15-23-13-6-7-14-23;/h2-5,8-11H,6-7,12-15H2,1H3;1H