2-[(3-oxidanylpiperidin-1-yl)sulfonylmethyl]benzenecarbonitrile

Systemtic Name: 2-[(3-oxidanylpiperidin-1-yl)sulfonylmethyl]benzenecarbonitrile Openeye Name: 2-[(3-hydroxy-1-piperidyl)sulfonylmethyl]benzonitrile CAS Name: 2-[(3-hydroxy-1-piperidinyl)sulfonylmethyl]benzonitrile IUPAC Name: 2-[(3-hydroxypiperidin-1-yl)sulfonylmethyl]benzonitrile Traditional Name: 2-[(3-hydroxypiperidino)sulfonylmethyl]benzonitrile Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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