4-[4-(3-cyano-2-methyl-propanoyl)phenyl]-3-methyl-4-oxidanylidene-butanenitrile

Systemtic Name: 4-[4-(3-cyano-2-methyl-propanoyl)phenyl]-3-methyl-4-oxidanylidene-butanenitrile Openeye Name: 4-[4-(3-cyano-2-methyl-propanoyl)phenyl]-3-methyl-4-oxo-butanenitrile CAS Name: 4-[4-(3-cyano-2-methyl-1-oxopropyl)phenyl]-3-methyl-4-oxobutanenitrile IUPAC Name: 4-[4-(3-cyano-2-methylpropanoyl)phenyl]-3-methyl-4-oxobutanenitrile Traditional Name: 4-[4-(3-cyano-2-methyl-propanoyl)phenyl]-4-keto-3-methyl-butyronitrile Formula: C16H16N2O2 MolecularWeight: 268.31044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O2/c1-11(7-9-17)15(19)13-3-5-14(6-4-13)16(20)12(2)8-10-18/h3-6,11-12H,7-8H2,1-2H3