1-(azepan-1-yl)-3-(benzimidazol-1-yl)propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-(benzimidazol-1-yl)propan-1-one Openeye Name: 1-(azepan-1-yl)-3-(benzimidazol-1-yl)propan-1-one CAS Name: 1-(1-azepanyl)-3-(1-benzimidazolyl)-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-(benzimidazol-1-yl)propan-1-one Traditional Name: 1-(azepan-1-yl)-3-(benzimidazol-1-yl)propan-1-one Formula: C16H21N3O MolecularWeight: 271.35744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCN2C=NC3=CC=CC=C32

Isomeric SMILES

C1CCCN(CC1)C(=O)CCN2C=NC3=CC=CC=C32

InChI

InChI=1S/C16H21N3O/c20-16(18-10-5-1-2-6-11-18)9-12-19-13-17-14-7-3-4-8-15(14)19/h3-4,7-8,13H,1-2,5-6,9-12H2