2-[2-(hydroxymethyl)piperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[2-(hydroxymethyl)piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[2-(hydroxymethyl)-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[2-(hydroxymethyl)-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[2-(hydroxymethyl)piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-(2-methylolpiperidino)sulfonylbenzonitrile Formula: C13H16N2O3S MolecularWeight: 280.34274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CO)S(=O)(=O)C2=CC=CC=C2C#N

Isomeric SMILES

C1CCN(C(C1)CO)S(=O)(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C13H16N2O3S/c14-9-11-5-1-2-7-13(11)19(17,18)15-8-4-3-6-12(15)10-16/h1-2,5,7,12,16H,3-4,6,8,10H2