3-[[4-(aminomethyl)piperidin-1-yl]sulfonylmethyl]benzenecarbonitrile

Systemtic Name: 3-[[4-(aminomethyl)piperidin-1-yl]sulfonylmethyl]benzenecarbonitrile Openeye Name: 3-[[4-(aminomethyl)-1-piperidyl]sulfonylmethyl]benzonitrile CAS Name: 3-[[4-(aminomethyl)-1-piperidinyl]sulfonylmethyl]benzonitrile IUPAC Name: 3-[[4-(aminomethyl)piperidin-1-yl]sulfonylmethyl]benzonitrile Traditional Name: 3-[[4-(aminomethyl)piperidino]sulfonylmethyl]benzonitrile Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)S(=O)(=O)CC2=CC=CC(=C2)C#N

Isomeric SMILES

C1CN(CCC1CN)S(=O)(=O)CC2=CC=CC(=C2)C#N

InChI

InChI=1S/C14H19N3O2S/c15-9-12-4-6-17(7-5-12)20(18,19)11-14-3-1-2-13(8-14)10-16/h1-3,8,12H,4-7,9,11,15H2