(E)-3-(2,5-dimethoxyphenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(2,5-dimethoxyphenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(2,5-dimethoxyphenyl)-1-[4-(4-pyridylmethyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(2,5-dimethoxyphenyl)-1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(2,5-dimethoxyphenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(2,5-dimethoxyphenyl)-1-[4-(4-pyridylmethyl)piperazino]prop-2-en-1-one Formula: C21H25N3O3 MolecularWeight: 367.4415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C=CC(=O)N2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)/C=C/C(=O)N2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C21H25N3O3/c1-26-19-4-5-20(27-2)18(15-19)3-6-21(25)24-13-11-23(12-14-24)16-17-7-9-22-10-8-17/h3-10,15H,11-14,16H2,1-2H3/b6-3+