3-[(E)-3-oxidanylidene-2-(phenylcarbonyl)but-1-enyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-3-oxidanylidene-2-(phenylcarbonyl)but-1-enyl]benzenecarbonitrile Openeye Name: 3-[(E)-2-benzoyl-3-oxo-but-1-enyl]benzonitrile CAS Name: 3-[(E)-2-benzoyl-3-oxobut-1-enyl]benzonitrile IUPAC Name: 3-[(E)-2-benzoyl-3-oxobut-1-enyl]benzonitrile Traditional Name: 3-[(E)-2-benzoyl-3-keto-but-1-enyl]benzonitrile Formula: C18H13NO2 MolecularWeight: 275.30132

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CC(=C1)C#N)C(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C18H13NO2/c1-13(20)17(18(21)16-8-3-2-4-9-16)11-14-6-5-7-15(10-14)12-19/h2-11H,1H3/b17-11+