(E)-3-(2-methylphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(2-methylphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-(4-benzylpiperazin-1-yl)-3-(o-tolyl)prop-2-en-1-one CAS Name: (E)-3-(2-methylphenyl)-1-[4-(phenylmethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-1-(4-benzylpiperazin-1-yl)-3-(2-methylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-benzylpiperazino)-3-(o-tolyl)prop-2-en-1-one Formula: C21H24N2O MolecularWeight: 320.42806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CC(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1/C=C/C(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O/c1-18-7-5-6-10-20(18)11-12-21(24)23-15-13-22(14-16-23)17-19-8-3-2-4-9-19/h2-12H,13-17H2,1H3/b12-11+