1-[4-(methylsulfonylmethyl)phenyl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-(methylsulfonylmethyl)phenyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[4-(methylsulfonylmethyl)benzoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-(methylsulfonylmethyl)phenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-(methylsulfonylmethyl)benzoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-(mesylmethyl)benzoyl]proline Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C14H17NO5S/c1-21(19,20)9-10-4-6-11(7-5-10)13(16)15-8-2-3-12(15)14(17)18/h4-7,12H,2-3,8-9H2,1H3,(H,17,18)