(E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-keto-2-piperidino-ethyl)piperazino]prop-2-en-1-one Formula: C22H31N3O4 MolecularWeight: 401.49924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCN(CC2)CC(=O)N3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCN(CC2)CC(=O)N3CCCCC3)OC

InChI

InChI=1S/C22H31N3O4/c1-28-19-8-6-18(16-20(19)29-2)7-9-21(26)25-14-12-23(13-15-25)17-22(27)24-10-4-3-5-11-24/h6-9,16H,3-5,10-15,17H2,1-2H3/b9-7+