(3R)-N-[3-[(3R)-3-methylpiperidin-1-ium-1-yl]propyl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-[3-[(3R)-3-methylpiperidin-1-ium-1-yl]propyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-[3-[(3R)-3-methylpiperidin-1-ium-1-yl]propyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: (3R)-N-[3-[(3R)-3-methyl-1-piperidin-1-iumyl]propyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-[3-[(3R)-3-methylpiperidin-1-ium-1-yl]propyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: (3R)-1-mesyl-N-[3-[(3R)-3-methylpiperidin-1-ium-1-yl]propyl]nipecotamide Formula: C16H32N3O3S+ MolecularWeight: 346.50858

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCNC(=O)C2CCCN(C2)S(=O)(=O)C

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CCCNC(=O)[C@@H]2CCCN(C2)S(=O)(=O)C

InChI

InChI=1S/C16H31N3O3S/c1-14-6-3-9-18(12-14)10-5-8-17-16(20)15-7-4-11-19(13-15)23(2,21)22/h14-15H,3-13H2,1-2H3,(H,17,20)/p+1/t14-,15-/m1/s1