4-(3-oxidanylidene-3-pyridin-4-yl-propanoyl)benzenecarbonitrile

Systemtic Name: 4-(3-oxidanylidene-3-pyridin-4-yl-propanoyl)benzenecarbonitrile Openeye Name: 4-[3-oxo-3-(4-pyridyl)propanoyl]benzonitrile CAS Name: 4-(1,3-dioxo-3-pyridin-4-ylpropyl)benzonitrile IUPAC Name: 4-(3-oxo-3-pyridin-4-ylpropanoyl)benzonitrile Traditional Name: 4-[3-keto-3-(4-pyridyl)propanoyl]benzonitrile Formula: C15H10N2O2 MolecularWeight: 250.2521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)CC(=O)C2=CC=NC=C2

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)CC(=O)C2=CC=NC=C2

InChI

InChI=1S/C15H10N2O2/c16-10-11-1-3-12(4-2-11)14(18)9-15(19)13-5-7-17-8-6-13/h1-8H,9H2