1-(2-ethylsulfonylphenyl)carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-(2-ethylsulfonylphenyl)carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-(2-ethylsulfonylbenzoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-ethylsulfonylphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-ethylsulfonylbenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(2-esylbenzoyl)proline Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C14H17NO5S/c1-2-21(19,20)12-8-4-3-6-10(12)13(16)15-9-5-7-11(15)14(17)18/h3-4,6,8,11H,2,5,7,9H2,1H3,(H,17,18)