1-(phenylsulfonyl)-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-(phenylsulfonyl)-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-4-(1-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-4-piperidin-1-ium-1-ylpiperidine-4-carboxamide Traditional Name: 1-besyl-4-piperidin-1-ium-1-yl-isonipecotamide Formula: C17H26N3O3S+ MolecularWeight: 352.47164

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1CC[NH+](CC1)C2(CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C17H25N3O3S/c18-16(21)17(19-11-5-2-6-12-19)9-13-20(14-10-17)24(22,23)15-7-3-1-4-8-15/h1,3-4,7-8H,2,5-6,9-14H2,(H2,18,21)/p+1