3-oxidanylidene-4-phenoxy-2-phenyl-butanenitrile

Systemtic Name: 3-oxidanylidene-4-phenoxy-2-phenyl-butanenitrile Openeye Name: 3-oxo-4-phenoxy-2-phenyl-butanenitrile CAS Name: 3-oxo-4-phenoxy-2-phenylbutanenitrile IUPAC Name: 3-oxo-4-phenoxy-2-phenylbutanenitrile Traditional Name: 3-keto-4-phenoxy-2-phenyl-butyronitrile Formula: C16H13NO2 MolecularWeight: 251.27992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)C(=O)COC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)C(=O)COC2=CC=CC=C2

InChI

InChI=1S/C16H13NO2/c17-11-15(13-7-3-1-4-8-13)16(18)12-19-14-9-5-2-6-10-14/h1-10,15H,12H2