3-oxidanylidene-2-phenyl-propanenitrile; 3-oxidanylidene-3-phenyl-propanenitrile

Systemtic Name: 3-oxidanylidene-2-phenyl-propanenitrile; 3-oxidanylidene-3-phenyl-propanenitrile Openeye Name: 3-oxo-2-phenyl-propanenitrile; 3-oxo-3-phenyl-propanenitrile CAS Name: 3-oxo-2-phenylpropanenitrile; 3-oxo-3-phenylpropanenitrile IUPAC Name: 3-oxo-2-phenylpropanenitrile; 3-oxo-3-phenylpropanenitrile Traditional Name: 3-keto-2-phenyl-propionitrile; 3-keto-3-phenyl-propionitrile Formula: C18H14N2O2 MolecularWeight: 290.31596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C=O)C#N.C1=CC=C(C=C1)C(=O)CC#N

Isomeric SMILES

C1=CC=C(C=C1)C(C=O)C#N.C1=CC=C(C=C1)C(=O)CC#N

InChI

InChI=1S/2C9H7NO/c10-6-9(7-11)8-4-2-1-3-5-8;10-7-6-9(11)8-4-2-1-3-5-8/h1-5,7,9H;1-5H,6H2