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

Systemtic Name: (E)-3-(3,4-diethoxyphenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3,4-diethoxyphenyl)-1-[4-(4-pyridylmethyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3,4-diethoxyphenyl)-1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3,4-diethoxyphenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3,4-diethoxyphenyl)-1-[4-(4-pyridylmethyl)piperazino]prop-2-en-1-one Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3/c1-3-28-21-7-5-19(17-22(21)29-4-2)6-8-23(27)26-15-13-25(14-16-26)18-20-9-11-24-12-10-20/h5-12,17H,3-4,13-16,18H2,1-2H3/b8-6+