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

Systemtic Name: (E)-4-pyridin-2-yl-1-pyridin-3-yl-but-3-en-2-one Openeye Name: (E)-4-(2-pyridyl)-1-(3-pyridyl)but-3-en-2-one CAS Name: (E)-4-(2-pyridinyl)-1-(3-pyridinyl)-3-buten-2-one IUPAC Name: (E)-4-pyridin-2-yl-1-pyridin-3-ylbut-3-en-2-one Traditional Name: (E)-4-(2-pyridyl)-1-(3-pyridyl)but-3-en-2-one Formula: C14H12N2O MolecularWeight: 224.25788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C=CC(=O)CC2=CN=CC=C2

Isomeric SMILES

C1=CC=NC(=C1)/C=C/C(=O)CC2=CN=CC=C2

InChI

InChI=1S/C14H12N2O/c17-14(10-12-4-3-8-15-11-12)7-6-13-5-1-2-9-16-13/h1-9,11H,10H2/b7-6+