2-(3,4-diethoxyphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3,4-diethoxyphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(3,4-diethoxyphenyl)ethanone CAS Name: 2-(3,4-diethoxyphenyl)-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(3,4-diethoxyphenyl)ethanone Traditional Name: 1-(4-benzylpiperazino)-2-(3,4-diethoxyphenyl)ethanone Formula: C23H30N2O3 MolecularWeight: 382.4959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC(=O)N2CCN(CC2)CC3=CC=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC(=O)N2CCN(CC2)CC3=CC=CC=C3)OCC

InChI

InChI=1S/C23H30N2O3/c1-3-27-21-11-10-20(16-22(21)28-4-2)17-23(26)25-14-12-24(13-15-25)18-19-8-6-5-7-9-19/h5-11,16H,3-4,12-15,17-18H2,1-2H3