3-[4-(piperidin-1-ylmethyl)piperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 3-[4-(piperidin-1-ylmethyl)piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 3-[[4-(1-piperidylmethyl)-1-piperidyl]sulfonyl]benzonitrile CAS Name: 3-[[4-(1-piperidinylmethyl)-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 3-[4-(piperidin-1-ylmethyl)piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 3-[4-(piperidinomethyl)piperidino]sulfonylbenzonitrile Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CCN(CC1)CC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H25N3O2S/c19-14-17-5-4-6-18(13-17)24(22,23)21-11-7-16(8-12-21)15-20-9-2-1-3-10-20/h4-6,13,16H,1-3,7-12,15H2