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

Systemtic Name: 2-ethyl-1-[4-(2-methylphenyl)piperazin-1-yl]butan-1-one Openeye Name: 2-ethyl-1-[4-(o-tolyl)piperazin-1-yl]butan-1-one CAS Name: 2-ethyl-1-[4-(2-methylphenyl)-1-piperazinyl]-1-butanone IUPAC Name: 2-ethyl-1-[4-(2-methylphenyl)piperazin-1-yl]butan-1-one Traditional Name: 2-ethyl-1-[4-(o-tolyl)piperazino]butan-1-one Formula: C17H26N2O MolecularWeight: 274.40114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCN(CC1)C2=CC=CC=C2C

Isomeric SMILES

CCC(CC)C(=O)N1CCN(CC1)C2=CC=CC=C2C

InChI

InChI=1S/C17H26N2O/c1-4-15(5-2)17(20)19-12-10-18(11-13-19)16-9-7-6-8-14(16)3/h6-9,15H,4-5,10-13H2,1-3H3