3-methyl-2-(2-oxidanylideneethyl)-2-phenyl-butanenitrile

Systemtic Name: 3-methyl-2-(2-oxidanylideneethyl)-2-phenyl-butanenitrile Openeye Name: 3-methyl-2-(2-oxoethyl)-2-phenyl-butanenitrile CAS Name: 3-methyl-2-(2-oxoethyl)-2-phenylbutanenitrile IUPAC Name: 3-methyl-2-(2-oxoethyl)-2-phenylbutanenitrile Traditional Name: 2-(2-ketoethyl)-3-methyl-2-phenyl-butyronitrile Formula: C13H15NO MolecularWeight: 201.2643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO/c1-11(2)13(10-14,8-9-15)12-6-4-3-5-7-12/h3-7,9,11H,8H2,1-2H3