3-[(1S,3S)-3-tert-butylcyclohexyl]propanenitrile

Systemtic Name: 3-[(1S,3S)-3-tert-butylcyclohexyl]propanenitrile Openeye Name: 3-[(1S,3S)-3-tert-butylcyclohexyl]propanenitrile CAS Name: 3-[(1S,3S)-3-tert-butylcyclohexyl]propanenitrile IUPAC Name: 3-[(1S,3S)-3-tert-butylcyclohexyl]propanenitrile Traditional Name: 3-[(1S,3S)-3-tert-butylcyclohexyl]propionitrile Formula: C13H23N MolecularWeight: 193.32842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCCC(C1)CCC#N

Isomeric SMILES

CC(C)(C)[C@H]1CCC[C@H](C1)CCC#N

InChI

InChI=1S/C13H23N/c1-13(2,3)12-8-4-6-11(10-12)7-5-9-14/h11-12H,4-8,10H2,1-3H3/t11-,12-/m0/s1