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

Systemtic Name: (E)-4-(2-methylphenyl)-3-pyridin-4-yl-but-3-en-2-one Openeye Name: (E)-4-(o-tolyl)-3-(4-pyridyl)but-3-en-2-one CAS Name: (E)-4-(2-methylphenyl)-3-pyridin-4-yl-3-buten-2-one IUPAC Name: (E)-4-(2-methylphenyl)-3-pyridin-4-ylbut-3-en-2-one Traditional Name: (E)-4-(o-tolyl)-3-(4-pyridyl)but-3-en-2-one Formula: C16H15NO MolecularWeight: 237.2964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C(C2=CC=NC=C2)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1/C=C(\C2=CC=NC=C2)/C(=O)C

InChI

InChI=1S/C16H15NO/c1-12-5-3-4-6-15(12)11-16(13(2)18)14-7-9-17-10-8-14/h3-11H,1-2H3/b16-11-