[(R)-cyano(cyclohexyl)methyl] 4-methylbenzenesulfonate

Systemtic Name: [(R)-cyano(cyclohexyl)methyl] 4-methylbenzenesulfonate Openeye Name: [(R)-cyano(cyclohexyl)methyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(R)-cyano(cyclohexyl)methyl] ester IUPAC Name: [(R)-cyano(cyclohexyl)methyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(R)-cyano(cyclohexyl)methyl] ester Formula: C15H19NO3S MolecularWeight: 293.38126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C#N)C2CCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H](C#N)C2CCCCC2

InChI

InChI=1S/C15H19NO3S/c1-12-7-9-14(10-8-12)20(17,18)19-15(11-16)13-5-3-2-4-6-13/h7-10,13,15H,2-6H2,1H3/t15-/m0/s1