3-[(2S)-1-phenethylsulfonylpiperidin-2-yl]propanenitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCC#N)S(=O)(=O)CCC2=CC=CC=C2

Isomeric SMILES

C1CCN([C@@H](C1)CCC#N)S(=O)(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C16H22N2O2S/c17-12-6-10-16-9-4-5-13-18(16)21(19,20)14-11-15-7-2-1-3-8-15/h1-3,7-8,16H,4-6,9-11,13-14H2/t16-/m0/s1