2-[[3-(hydroxymethyl)piperidin-1-yl]sulfonylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[3-(hydroxymethyl)piperidin-1-yl]sulfonylmethyl]benzenecarbonitrile Openeye Name: 2-[[3-(hydroxymethyl)-1-piperidyl]sulfonylmethyl]benzonitrile CAS Name: 2-[[3-(hydroxymethyl)-1-piperidinyl]sulfonylmethyl]benzonitrile IUPAC Name: 2-[[3-(hydroxymethyl)piperidin-1-yl]sulfonylmethyl]benzonitrile Traditional Name: 2-[(3-methylolpiperidino)sulfonylmethyl]benzonitrile Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CC2=CC=CC=C2C#N)CO

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CC2=CC=CC=C2C#N)CO

InChI

InChI=1S/C14H18N2O3S/c15-8-13-5-1-2-6-14(13)11-20(18,19)16-7-3-4-12(9-16)10-17/h1-2,5-6,12,17H,3-4,7,9-11H2