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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)[NH+]2CC(CC2C(=O)[O-])OC

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)[NH+]2C[C@H](C[C@@H]2C(=O)[O-])OC

InChI

InChI=1S/C12H22N2O5S/c1-9-3-5-13(6-4-9)20(17,18)14-8-10(19-2)7-11(14)12(15)16/h9-11H,3-8H2,1-2H3,(H,15,16)/t10-,11+/m0/s1