tert-butyl 2-(hydroxymethyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate; 4-methylbenzenesulfonic acid

Systemtic Name: tert-butyl 2-(hydroxymethyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate; 4-methylbenzenesulfonic acid Openeye Name: tert-butyl 2-(hydroxymethyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate; 4-methylbenzenesulfonic acid CAS Name: 2-(hydroxymethyl)-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid tert-butyl ester; 4-methylbenzenesulfonic acid IUPAC Name: tert-butyl 2-(hydroxymethyl)-4-methylsulfonyloxypyrrolidine-1-carboxylate; 4-methylbenzenesulfonic acid Traditional Name: 2-methylol-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid tert-butyl ester; tosylic acid Formula: C18H29NO9S2 MolecularWeight: 467.55416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)(C)OC(=O)N1CC(CC1CO)OS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)(C)OC(=O)N1CC(CC1CO)OS(=O)(=O)C

InChI

InChI=1S/C11H21NO6S.C7H8O3S/c1-11(2,3)17-10(14)12-6-9(5-8(12)7-13)18-19(4,15)16;1-6-2-4-7(5-3-6)11(8,9)10/h8-9,13H,5-7H2,1-4H3;2-5H,1H3,(H,8,9,10)