2-[4-(2-methylphenyl)piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)propan-1-one

Systemtic Name: 2-[4-(2-methylphenyl)piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)propan-1-one Openeye Name: 2-[4-(o-tolyl)piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)propan-1-one CAS Name: 2-[4-(2-methylphenyl)-1-piperazinyl]-1-(3,4,5-trimethoxyphenyl)-1-propanone IUPAC Name: 2-[4-(2-methylphenyl)piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)propan-1-one Traditional Name: 2-[4-(o-tolyl)piperazino]-1-(3,4,5-trimethoxyphenyl)propan-1-one Formula: C23H30N2O4 MolecularWeight: 398.4953

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(C)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(C)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C23H30N2O4/c1-16-8-6-7-9-19(16)25-12-10-24(11-13-25)17(2)22(26)18-14-20(27-3)23(29-5)21(15-18)28-4/h6-9,14-15,17H,10-13H2,1-5H3