2-[2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]-2-phenyl-ethanenitrile

Systemtic Name: 2-[2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]-2-phenyl-ethanenitrile Openeye Name: 2-(2,4-dioxo-1H-pyrimidin-3-yl)-2-phenyl-acetonitrile CAS Name: 2-(2,4-dioxo-1H-pyrimidin-3-yl)-2-phenylacetonitrile IUPAC Name: 2-(2,4-dioxo-1H-pyrimidin-3-yl)-2-phenylacetonitrile Traditional Name: 2-(2,4-diketo-1H-pyrimidin-3-yl)-2-phenyl-acetonitrile Formula: C12H9N3O2 MolecularWeight: 227.21876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)N2C(=O)C=CNC2=O

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)N2C(=O)C=CNC2=O

InChI

InChI=1S/C12H9N3O2/c13-8-10(9-4-2-1-3-5-9)15-11(16)6-7-14-12(15)17/h1-7,10H,(H,14,17)