2-(2-methylphenoxy)-1-[4-(phenylmethyl)piperazin-1-yl]butan-1-one

Systemtic Name: 2-(2-methylphenoxy)-1-[4-(phenylmethyl)piperazin-1-yl]butan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(2-methylphenoxy)butan-1-one CAS Name: 2-(2-methylphenoxy)-1-[4-(phenylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(2-methylphenoxy)butan-1-one Traditional Name: 1-(4-benzylpiperazino)-2-(2-methylphenoxy)butan-1-one Formula: C22H28N2O2 MolecularWeight: 352.46992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)OC3=CC=CC=C3C

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)OC3=CC=CC=C3C

InChI

InChI=1S/C22H28N2O2/c1-3-20(26-21-12-8-7-9-18(21)2)22(25)24-15-13-23(14-16-24)17-19-10-5-4-6-11-19/h4-12,20H,3,13-17H2,1-2H3