1-[3-(4-chloranyl-3-sulfamoyl-phenyl)carbonylsulfanylpropanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-(4-chloranyl-3-sulfamoyl-phenyl)carbonylsulfanylpropanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-(4-chloro-3-sulfamoyl-benzoyl)sulfanylpropanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-[[(4-chloro-3-sulfamoylphenyl)-oxomethyl]thio]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-(4-chloro-3-sulfamoylbenzoyl)sulfanylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-[(4-chloro-3-sulfamoyl-benzoyl)thio]propanoyl]proline Formula: C15H17ClN2O6S2 MolecularWeight: 420.88828

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCSC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)CCSC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C15H17ClN2O6S2/c16-10-4-3-9(8-12(10)26(17,23)24)15(22)25-7-5-13(19)18-6-1-2-11(18)14(20)21/h3-4,8,11H,1-2,5-7H2,(H,20,21)(H2,17,23,24)