2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[(3R,5R)-3,5-dimethylpiperidino]sulfonylbenzonitrile Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2C#N)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)S(=O)(=O)C2=CC=CC=C2C#N)C

InChI

InChI=1S/C14H18N2O2S/c1-11-7-12(2)10-16(9-11)19(17,18)14-6-4-3-5-13(14)8-15/h3-6,11-12H,7,9-10H2,1-2H3/t11-,12-/m1/s1