2-(hydroxymethyl)-4-(4-methylphenyl)sulfonyloxy-pyrrolidine-1-carboxylic acid

Systemtic Name: 2-(hydroxymethyl)-4-(4-methylphenyl)sulfonyloxy-pyrrolidine-1-carboxylic acid Openeye Name: 2-(hydroxymethyl)-4-(p-tolylsulfonyloxy)pyrrolidine-1-carboxylic acid CAS Name: 2-(hydroxymethyl)-4-(4-methylphenyl)sulfonyloxy-1-pyrrolidinecarboxylic acid IUPAC Name: 2-(hydroxymethyl)-4-(4-methylphenyl)sulfonyloxypyrrolidine-1-carboxylic acid Traditional Name: 2-methylol-4-tosyloxy-pyrrolidine-1-carboxylic acid Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(N(C2)C(=O)O)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(N(C2)C(=O)O)CO

InChI

InChI=1S/C13H17NO6S/c1-9-2-4-12(5-3-9)21(18,19)20-11-6-10(8-15)14(7-11)13(16)17/h2-5,10-11,15H,6-8H2,1H3,(H,16,17)