(3R)-N-[3-[(3R,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-[3-[(3R,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-[3-[(3R,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: (3R)-N-[3-[(3R,5S)-3,5-dimethyl-1-piperidin-1-iumyl]propyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-[3-[(3R,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-[3-[(3R,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-1-propylsulfonyl-nipecotamide Formula: C19H38N3O3S+ MolecularWeight: 388.58832

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NCCC[NH+]2CC(CC(C2)C)C

Isomeric SMILES

CCCS(=O)(=O)N1CCC[C@H](C1)C(=O)NCCC[NH+]2C[C@@H](C[C@@H](C2)C)C

InChI

InChI=1S/C19H37N3O3S/c1-4-11-26(24,25)22-10-5-7-18(15-22)19(23)20-8-6-9-21-13-16(2)12-17(3)14-21/h16-18H,4-15H2,1-3H3,(H,20,23)/p+1/t16-,17+,18-/m1/s1