(2S)-2-(4-fluoranyl-3-methyl-phenyl)butanenitrile

Systemtic Name: (2S)-2-(4-fluoranyl-3-methyl-phenyl)butanenitrile Openeye Name: (2S)-2-(4-fluoro-3-methyl-phenyl)butanenitrile CAS Name: (2S)-2-(4-fluoro-3-methylphenyl)butanenitrile IUPAC Name: (2S)-2-(4-fluoro-3-methylphenyl)butanenitrile Traditional Name: (2S)-2-(4-fluoro-3-methyl-phenyl)butyronitrile Formula: C11H12FN MolecularWeight: 177.218083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C#N)C1=CC(=C(C=C1)F)C

InChI

InChI=1S/C11H12FN/c1-3-9(7-13)10-4-5-11(12)8(2)6-10/h4-6,9H,3H2,1-2H3/t9-/m1/s1