5-(2-fluoranyl-4-methoxy-phenyl)-4,4-dimethyl-5-oxidanylidene-pentanenitrile

Systemtic Name: 5-(2-fluoranyl-4-methoxy-phenyl)-4,4-dimethyl-5-oxidanylidene-pentanenitrile Openeye Name: 5-(2-fluoro-4-methoxy-phenyl)-4,4-dimethyl-5-oxo-pentanenitrile CAS Name: 5-(2-fluoro-4-methoxyphenyl)-4,4-dimethyl-5-oxopentanenitrile IUPAC Name: 5-(2-fluoro-4-methoxyphenyl)-4,4-dimethyl-5-oxopentanenitrile Traditional Name: 5-(2-fluoro-4-methoxy-phenyl)-5-keto-4,4-dimethyl-valeronitrile Formula: C14H16FNO2 MolecularWeight: 249.280743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC#N)C(=O)C1=C(C=C(C=C1)OC)F

Isomeric SMILES

CC(C)(CCC#N)C(=O)C1=C(C=C(C=C1)OC)F

InChI

InChI=1S/C14H16FNO2/c1-14(2,7-4-8-16)13(17)11-6-5-10(18-3)9-12(11)15/h5-6,9H,4,7H2,1-3H3