4-[4-(hydroxymethyl)piperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(hydroxymethyl)piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[[4-(hydroxymethyl)-1-piperidyl]sulfonyl]benzonitrile CAS Name: 4-[[4-(hydroxymethyl)-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(hydroxymethyl)piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 4-(4-methylolpiperidino)sulfonylbenzonitrile Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CO)S(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

C1CN(CCC1CO)S(=O)(=O)C2=CC=C(C=C2)C#N

InChI

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