11-(6-pyrrolidin-1-ylhexyl)-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride

Systemtic Name: 11-(6-pyrrolidin-1-ylhexyl)-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Openeye Name: 11-(6-pyrrolidin-1-ylhexyl)-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride CAS Name: 11-[6-(1-pyrrolidinyl)hexyl]-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride IUPAC Name: 11-(6-pyrrolidin-1-ylhexyl)-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Traditional Name: 11-(6-pyrrolidinohexyl)-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Formula: C23H30ClN3O MolecularWeight: 399.9568

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCCCCN2C3=CC=CC=C3C(=O)NC4=CC=CC=C42.Cl

Isomeric SMILES

C1CCN(C1)CCCCCCN2C3=CC=CC=C3C(=O)NC4=CC=CC=C42.Cl

InChI

InChI=1S/C23H29N3O.ClH/c27-23-19-11-3-5-13-21(19)26(22-14-6-4-12-20(22)24-23)18-8-2-1-7-15-25-16-9-10-17-25;/h3-6,11-14H,1-2,7-10,15-18H2,(H,24,27);1H