2-[(3R,4S)-3-ethyl-1-methylsulfonyl-piperidin-4-yl]-N-(2-pyrrolidin-1-ium-1-ylethyl)ethanamide

Systemtic Name: 2-[(3R,4S)-3-ethyl-1-methylsulfonyl-piperidin-4-yl]-N-(2-pyrrolidin-1-ium-1-ylethyl)ethanamide Openeye Name: 2-[(3R,4S)-3-ethyl-1-methylsulfonyl-4-piperidyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide CAS Name: 2-[(3R,4S)-3-ethyl-1-methylsulfonyl-4-piperidinyl]-N-[2-(1-pyrrolidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-[(3R,4S)-3-ethyl-1-methylsulfonylpiperidin-4-yl]-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide Traditional Name: 2-[(3R,4S)-3-ethyl-1-mesyl-4-piperidyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide Formula: C16H32N3O3S+ MolecularWeight: 346.50858

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCC1CC(=O)NCC[NH+]2CCCC2)S(=O)(=O)C

Isomeric SMILES

CC[C@H]1CN(CC[C@H]1CC(=O)NCC[NH+]2CCCC2)S(=O)(=O)C

InChI

InChI=1S/C16H31N3O3S/c1-3-14-13-19(23(2,21)22)10-6-15(14)12-16(20)17-7-11-18-8-4-5-9-18/h14-15H,3-13H2,1-2H3,(H,17,20)/p+1/t14-,15-/m0/s1