(2S)-2-(2-chloranyl-6-fluoranyl-phenyl)-2-(cyclopentylamino)ethanenitrile

Systemtic Name: (2S)-2-(2-chloranyl-6-fluoranyl-phenyl)-2-(cyclopentylamino)ethanenitrile Openeye Name: (2S)-2-(2-chloro-6-fluoro-phenyl)-2-(cyclopentylamino)acetonitrile CAS Name: (2S)-2-(2-chloro-6-fluorophenyl)-2-(cyclopentylamino)acetonitrile IUPAC Name: (2S)-2-(2-chloro-6-fluorophenyl)-2-(cyclopentylamino)acetonitrile Traditional Name: (2S)-2-(2-chloro-6-fluoro-phenyl)-2-(cyclopentylamino)acetonitrile Formula: C13H14ClFN2 MolecularWeight: 252.715063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(C#N)C2=C(C=CC=C2Cl)F

Isomeric SMILES

C1CCC(C1)N[C@H](C#N)C2=C(C=CC=C2Cl)F

InChI

InChI=1S/C13H14ClFN2/c14-10-6-3-7-11(15)13(10)12(8-16)17-9-4-1-2-5-9/h3,6-7,9,12,17H,1-2,4-5H2/t12-/m1/s1