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

Systemtic Name: (E)-3-(4-methylphenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(p-tolyl)-1-[4-(4-pyridylmethyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-methylphenyl)-1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-methylphenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(p-tolyl)-1-[4-(4-pyridylmethyl)piperazino]prop-2-en-1-one Formula: C20H23N3O MolecularWeight: 321.41612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C20H23N3O/c1-17-2-4-18(5-3-17)6-7-20(24)23-14-12-22(13-15-23)16-19-8-10-21-11-9-19/h2-11H,12-16H2,1H3/b7-6+