3-[(2S)-1-(4-ethylphenyl)sulfonylpiperidin-2-yl]propanenitrile

Systemtic Name: 3-[(2S)-1-(4-ethylphenyl)sulfonylpiperidin-2-yl]propanenitrile Openeye Name: 3-[(2S)-1-(4-ethylphenyl)sulfonyl-2-piperidyl]propanenitrile CAS Name: 3-[(2S)-1-(4-ethylphenyl)sulfonyl-2-piperidinyl]propanenitrile IUPAC Name: 3-[(2S)-1-(4-ethylphenyl)sulfonylpiperidin-2-yl]propanenitrile Traditional Name: 3-[(2S)-1-(4-ethylphenyl)sulfonyl-2-piperidyl]propionitrile Formula: C16H22N2O2S MolecularWeight: 306.42308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2CCC#N

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCCC[C@H]2CCC#N

InChI

InChI=1S/C16H22N2O2S/c1-2-14-8-10-16(11-9-14)21(19,20)18-13-4-3-6-15(18)7-5-12-17/h8-11,15H,2-7,13H2,1H3/t15-/m0/s1