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

Systemtic Name: 4-[4-(phenylmethyl)piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[(4-benzyl-1-piperidyl)sulfonyl]benzonitrile CAS Name: 4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 4-(4-benzylpiperidin-1-yl)sulfonylbenzonitrile Traditional Name: 4-(4-benzylpiperidino)sulfonylbenzonitrile Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H20N2O2S/c20-15-18-6-8-19(9-7-18)24(22,23)21-12-10-17(11-13-21)14-16-4-2-1-3-5-16/h1-9,17H,10-14H2