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

Systemtic Name: (E)-3-(4-propan-2-ylphenyl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-isopropylphenyl)-1-[4-(3-pyridylmethyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-propan-2-ylphenyl)-1-[4-(3-pyridinylmethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-propan-2-ylphenyl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-p-cumenyl-1-[4-(3-pyridylmethyl)piperazino]prop-2-en-1-one Formula: C22H27N3O MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)CC3=CN=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O/c1-18(2)21-8-5-19(6-9-21)7-10-22(26)25-14-12-24(13-15-25)17-20-4-3-11-23-16-20/h3-11,16,18H,12-15,17H2,1-2H3/b10-7+