(2S)-1-[2-chloranyl-5-(diethylsulfamoyl)phenyl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[2-chloranyl-5-(diethylsulfamoyl)phenyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[2-chloro-5-(diethylsulfamoyl)benzoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[[2-chloro-5-(diethylsulfamoyl)phenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[2-chloro-5-(diethylsulfamoyl)benzoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[2-chloro-5-(diethylsulfamoyl)benzoyl]proline Formula: C16H21ClN2O5S MolecularWeight: 388.86634

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCC[C@H]2C(=O)O

InChI

InChI=1S/C16H21ClN2O5S/c1-3-18(4-2)25(23,24)11-7-8-13(17)12(10-11)15(20)19-9-5-6-14(19)16(21)22/h7-8,10,14H,3-6,9H2,1-2H3,(H,21,22)/t14-/m0/s1