tert-butyl 2-(hydroxymethyl)-1-(4-methoxycarbonylcyclohexyl)oxy-pyrrolidin-1-ium-1-carboxylate

Systemtic Name: tert-butyl 2-(hydroxymethyl)-1-(4-methoxycarbonylcyclohexyl)oxy-pyrrolidin-1-ium-1-carboxylate Openeye Name: tert-butyl 2-(hydroxymethyl)-1-(4-methoxycarbonylcyclohexoxy)pyrrolidin-1-ium-1-carboxylate CAS Name: 2-(hydroxymethyl)-1-(4-methoxycarbonylcyclohexyl)oxy-1-pyrrolidin-1-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(hydroxymethyl)-1-(4-methoxycarbonylcyclohexyl)oxypyrrolidin-1-ium-1-carboxylate Traditional Name: 1-(4-carbomethoxycyclohexoxy)-2-methylol-pyrrolidin-1-ium-1-carboxylic acid tert-butyl ester Formula: C18H32NO6+ MolecularWeight: 358.44978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)[N+]1(CCCC1CO)OC2CCC(CC2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)[N+]1(CCCC1CO)OC2CCC(CC2)C(=O)OC

InChI

InChI=1S/C18H32NO6/c1-18(2,3)24-17(22)19(11-5-6-14(19)12-20)25-15-9-7-13(8-10-15)16(21)23-4/h13-15,20H,5-12H2,1-4H3/q+1