3-(1-phenethylpiperidin-3-yl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1-phenethylpiperidin-3-yl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-(1-phenethyl-3-piperidyl)propan-1-one CAS Name: 3-(1-phenethyl-3-piperidinyl)-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-(1-phenethylpiperidin-3-yl)propan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-(1-phenethyl-3-piperidyl)propan-1-one Formula: C27H37N3O MolecularWeight: 419.60218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCC2=CC=CC=C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)CCC2=CC=CC=C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H37N3O/c31-27(30-20-18-29(19-21-30)22-25-10-5-2-6-11-25)14-13-26-12-7-16-28(23-26)17-15-24-8-3-1-4-9-24/h1-6,8-11,26H,7,12-23H2