3-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 3-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 3-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzonitrile CAS Name: 3-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 3-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzonitrile Traditional Name: 3-[(3S)-3-methylpiperidino]sulfonylbenzonitrile Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O2S/c1-11-4-3-7-15(10-11)18(16,17)13-6-2-5-12(8-13)9-14/h2,5-6,8,11H,3-4,7,10H2,1H3/t11-/m0/s1