3-methyl-1-[4-[2-(3-methylphenoxy)ethanoyl]piperazin-1-yl]butan-1-one

Systemtic Name: 3-methyl-1-[4-[2-(3-methylphenoxy)ethanoyl]piperazin-1-yl]butan-1-one Openeye Name: 3-methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one CAS Name: 3-methyl-1-[4-[2-(3-methylphenoxy)-1-oxoethyl]-1-piperazinyl]-1-butanone IUPAC Name: 3-methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]butan-1-one Traditional Name: 3-methyl-1-[4-[2-(3-methylphenoxy)acetyl]piperazino]butan-1-one Formula: C18H26N2O3 MolecularWeight: 318.41064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)C(=O)CC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)C(=O)CC(C)C

InChI

InChI=1S/C18H26N2O3/c1-14(2)11-17(21)19-7-9-20(10-8-19)18(22)13-23-16-6-4-5-15(3)12-16/h4-6,12,14H,7-11,13H2,1-3H3