3-[(4-methylphenyl)sulfonylmethyl]pyrrolidine-1-carboxylic acid

Systemtic Name: 3-[(4-methylphenyl)sulfonylmethyl]pyrrolidine-1-carboxylic acid Openeye Name: 3-(p-tolylsulfonylmethyl)pyrrolidine-1-carboxylic acid CAS Name: 3-[(4-methylphenyl)sulfonylmethyl]-1-pyrrolidinecarboxylic acid IUPAC Name: 3-[(4-methylphenyl)sulfonylmethyl]pyrrolidine-1-carboxylic acid Traditional Name: 3-(tosylmethyl)pyrrolidine-1-carboxylic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2CCN(C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2CCN(C2)C(=O)O

InChI

InChI=1S/C13H17NO4S/c1-10-2-4-12(5-3-10)19(17,18)9-11-6-7-14(8-11)13(15)16/h2-5,11H,6-9H2,1H3,(H,15,16)