(2R,4S)-4-methoxy-1-[(3R)-3-methylpiperidin-1-yl]sulfonyl-pyrrolidin-1-ium-2-carboxylate

Systemtic Name: (2R,4S)-4-methoxy-1-[(3R)-3-methylpiperidin-1-yl]sulfonyl-pyrrolidin-1-ium-2-carboxylate Openeye Name: (2R,4S)-4-methoxy-1-[[(3R)-3-methyl-1-piperidyl]sulfonyl]pyrrolidin-1-ium-2-carboxylate CAS Name: (2R,4S)-4-methoxy-1-[[(3R)-3-methyl-1-piperidinyl]sulfonyl]-2-pyrrolidin-1-iumcarboxylate IUPAC Name: (2R,4S)-4-methoxy-1-[(3R)-3-methylpiperidin-1-yl]sulfonylpyrrolidin-1-ium-2-carboxylate Traditional Name: (2R,4S)-4-methoxy-1-[(3R)-3-methylpiperidino]sulfonyl-pyrrolidin-1-ium-2-carboxylate Formula: C12H22N2O5S MolecularWeight: 306.37848

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)[NH+]2CC(CC2C(=O)[O-])OC

Isomeric SMILES

C[C@@H]1CCCN(C1)S(=O)(=O)[NH+]2C[C@H](C[C@@H]2C(=O)[O-])OC

InChI

InChI=1S/C12H22N2O5S/c1-9-4-3-5-13(7-9)20(17,18)14-8-10(19-2)6-11(14)12(15)16/h9-11H,3-8H2,1-2H3,(H,15,16)/t9-,10+,11-/m1/s1