4-chloranyl-2-[2-(hydroxymethyl)piperidin-1-yl]sulfonyl-benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-[2-(hydroxymethyl)piperidin-1-yl]sulfonyl-benzenecarbonitrile Openeye Name: 4-chloro-2-[[2-(hydroxymethyl)-1-piperidyl]sulfonyl]benzonitrile CAS Name: 4-chloro-2-[[2-(hydroxymethyl)-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 4-chloro-2-[2-(hydroxymethyl)piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 4-chloro-2-(2-methylolpiperidino)sulfonyl-benzonitrile Formula: C13H15ClN2O3S MolecularWeight: 314.7878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClN2O3S/c14-11-5-4-10(8-15)13(7-11)20(18,19)16-6-2-1-3-12(16)9-17/h4-5,7,12,17H,1-3,6,9H2