4-[4-(phenylmethyl)piperidin-1-yl]sulfonylbutanenitrile

Systemtic Name: 4-[4-(phenylmethyl)piperidin-1-yl]sulfonylbutanenitrile Openeye Name: 4-[(4-benzyl-1-piperidyl)sulfonyl]butanenitrile CAS Name: 4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]butanenitrile IUPAC Name: 4-(4-benzylpiperidin-1-yl)sulfonylbutanenitrile Traditional Name: 4-(4-benzylpiperidino)sulfonylbutyronitrile Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)CCCC#N

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)CCCC#N

InChI

InChI=1S/C16H22N2O2S/c17-10-4-5-13-21(19,20)18-11-8-16(9-12-18)14-15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-9,11-14H2