(2S)-2-[[(R)-(4-methylphenyl)sulfinyl]methyl]-2-oxidanyl-hexadecanenitrile

Systemtic Name: (2S)-2-[[(R)-(4-methylphenyl)sulfinyl]methyl]-2-oxidanyl-hexadecanenitrile Openeye Name: (2S)-2-hydroxy-2-[[(R)-p-tolylsulfinyl]methyl]hexadecanenitrile CAS Name: (2S)-2-hydroxy-2-[[(R)-(4-methylphenyl)sulfinyl]methyl]hexadecanenitrile IUPAC Name: (2S)-2-hydroxy-2-[[(R)-(4-methylphenyl)sulfinyl]methyl]hexadecanenitrile Traditional Name: (2S)-2-hydroxy-2-[[(R)-p-tolylsulfinyl]methyl]palmitonitrile Formula: C24H39NO2S MolecularWeight: 405.63696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CS(=O)C1=CC=C(C=C1)C)(C#N)O

Isomeric SMILES

CCCCCCCCCCCCCC[C@@](C[S@@](=O)C1=CC=C(C=C1)C)(C#N)O

InChI

InChI=1S/C24H39NO2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-19-24(26,20-25)21-28(27)23-17-15-22(2)16-18-23/h15-18,26H,3-14,19,21H2,1-2H3/t24-,28+/m0/s1