4-(1-methylpiperidin-4-yl)-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 4-(1-methylpiperidin-4-yl)-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-isobutyl-4-(1-methyl-4-piperidyl)-1,4-diazepan-2-one CAS Name: 4-(1-methyl-4-piperidinyl)-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 4-(1-methylpiperidin-4-yl)-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-isobutyl-4-(1-methyl-4-piperidyl)-1,4-diazepan-2-one Formula: C22H35N3O2 MolecularWeight: 373.5322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C2CCN(CC2)C)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C2CCN(CC2)C)OCC3=CC=CC=C3

InChI

InChI=1S/C22H35N3O2/c1-18(2)13-25-15-21(27-17-19-7-5-4-6-8-19)14-24(16-22(25)26)20-9-11-23(3)12-10-20/h4-8,18,20-21H,9-17H2,1-3H3