(E)-4-(4-methylphenyl)-3-piperidin-1-yl-but-3-en-2-one

Systemtic Name: (E)-4-(4-methylphenyl)-3-piperidin-1-yl-but-3-en-2-one Openeye Name: (E)-3-(1-piperidyl)-4-(p-tolyl)but-3-en-2-one CAS Name: (E)-4-(4-methylphenyl)-3-(1-piperidinyl)-3-buten-2-one IUPAC Name: (E)-4-(4-methylphenyl)-3-piperidin-1-ylbut-3-en-2-one Traditional Name: (E)-3-piperidino-4-(p-tolyl)but-3-en-2-one Formula: C16H21NO MolecularWeight: 243.34404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C(=O)C)N2CCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C(=O)C)/N2CCCCC2

InChI

InChI=1S/C16H21NO/c1-13-6-8-15(9-7-13)12-16(14(2)18)17-10-4-3-5-11-17/h6-9,12H,3-5,10-11H2,1-2H3/b16-12+