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

Systemtic Name: tert-butyl (2S)-2-(hydroxymethyl)pyrrolidine-1-carboxylate; 4-methylbenzenesulfonic acid Openeye Name: tert-butyl (2S)-2-(hydroxymethyl)pyrrolidine-1-carboxylate; 4-methylbenzenesulfonic acid CAS Name: (2S)-2-(hydroxymethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester; 4-methylbenzenesulfonic acid IUPAC Name: tert-butyl (2S)-2-(hydroxymethyl)pyrrolidine-1-carboxylate; 4-methylbenzenesulfonic acid Traditional Name: (2S)-2-methylolpyrrolidine-1-carboxylic acid tert-butyl ester; tosylic acid Formula: C17H27NO6S MolecularWeight: 373.46438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)(C)OC(=O)N1CCCC1CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)(C)OC(=O)N1CCC[C@H]1CO

InChI

InChI=1S/C10H19NO3.C7H8O3S/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12;1-6-2-4-7(5-3-6)11(8,9)10/h8,12H,4-7H2,1-3H3;2-5H,1H3,(H,8,9,10)/t8-;/m0./s1