4-[(E)-3-oxidanylidene-4-pyridin-3-yl-but-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-oxidanylidene-4-pyridin-3-yl-but-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-oxo-4-(3-pyridyl)but-1-enyl]benzonitrile CAS Name: 4-[(E)-3-oxo-4-(3-pyridinyl)but-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-oxo-4-pyridin-3-ylbut-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-keto-4-(3-pyridyl)but-1-enyl]benzonitrile Formula: C16H12N2O MolecularWeight: 248.27928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC(=O)C=CC2=CC=C(C=C2)C#N

Isomeric SMILES

C1=CC(=CN=C1)CC(=O)/C=C/C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H12N2O/c17-11-14-5-3-13(4-6-14)7-8-16(19)10-15-2-1-9-18-12-15/h1-9,12H,10H2/b8-7+