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

Systemtic Name: 1-(2-methylphenyl)-4-[4-(phenylmethyl)piperazin-1-yl]butan-1-one Openeye Name: 4-(4-benzylpiperazin-1-yl)-1-(o-tolyl)butan-1-one CAS Name: 1-(2-methylphenyl)-4-[4-(phenylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(4-benzylpiperazin-1-yl)-1-(2-methylphenyl)butan-1-one Traditional Name: 4-(4-benzylpiperazino)-1-(o-tolyl)butan-1-one Formula: C22H28N2O MolecularWeight: 336.47052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)CCCN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C(=O)CCCN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O/c1-19-8-5-6-11-21(19)22(25)12-7-13-23-14-16-24(17-15-23)18-20-9-3-2-4-10-20/h2-6,8-11H,7,12-18H2,1H3