2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[(2S,6S)-2,6-dimethyl-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[(2S,6S)-2,6-dimethyl-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[(2S,6S)-2,6-dimethylpiperidino]sulfonylbenzonitrile Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=CC=C2C#N)C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1S(=O)(=O)C2=CC=CC=C2C#N)C

InChI

InChI=1S/C14H18N2O2S/c1-11-6-5-7-12(2)16(11)19(17,18)14-9-4-3-8-13(14)10-15/h3-4,8-9,11-12H,5-7H2,1-2H3/t11-,12-/m0/s1