tert-butyl 1-[(4-methoxycarbonylcyclohexyl)oxy-methylsulfonyl-methyl]pyrrolidin-1-ium-1-carboxylate

Systemtic Name: tert-butyl 1-[(4-methoxycarbonylcyclohexyl)oxy-methylsulfonyl-methyl]pyrrolidin-1-ium-1-carboxylate Openeye Name: tert-butyl 1-[(4-methoxycarbonylcyclohexoxy)-methylsulfonyl-methyl]pyrrolidin-1-ium-1-carboxylate CAS Name: 1-[(4-methoxycarbonylcyclohexyl)oxy-methylsulfonylmethyl]-1-pyrrolidin-1-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[(4-methoxycarbonylcyclohexyl)oxy-methylsulfonylmethyl]pyrrolidin-1-ium-1-carboxylate Traditional Name: 1-[(4-carbomethoxycyclohexoxy)-mesyl-methyl]pyrrolidin-1-ium-1-carboxylic acid tert-butyl ester Formula: C19H34NO7S+ MolecularWeight: 420.54076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)[N+]1(CCCC1)C(OC2CCC(CC2)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)[N+]1(CCCC1)C(OC2CCC(CC2)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C19H34NO7S/c1-19(2,3)27-17(22)20(12-6-7-13-20)18(28(5,23)24)26-15-10-8-14(9-11-15)16(21)25-4/h14-15,18H,6-13H2,1-5H3/q+1