2-[(4-chloranyl-2-ethanoylsulfanyl-5-sulfamoyl-phenyl)carbonyl-cyclopentyl-amino]ethanoic acid

Systemtic Name: 2-[(4-chloranyl-2-ethanoylsulfanyl-5-sulfamoyl-phenyl)carbonyl-cyclopentyl-amino]ethanoic acid Openeye Name: 2-[(2-acetylsulfanyl-4-chloro-5-sulfamoyl-benzoyl)-cyclopentyl-amino]acetic acid CAS Name: 2-[[[2-(acetylthio)-4-chloro-5-sulfamoylphenyl]-oxomethyl]-cyclopentylamino]acetic acid IUPAC Name: 2-[(2-acetylsulfanyl-4-chloro-5-sulfamoylbenzoyl)-cyclopentylamino]acetic acid Traditional Name: 2-[[2-(acetylthio)-4-chloro-5-sulfamoyl-benzoyl]-cyclopentyl-amino]acetic acid Formula: C16H19ClN2O6S2 MolecularWeight: 434.91486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1=CC(=C(C=C1C(=O)N(CC(=O)O)C2CCCC2)S(=O)(=O)N)Cl

Isomeric SMILES

CC(=O)SC1=CC(=C(C=C1C(=O)N(CC(=O)O)C2CCCC2)S(=O)(=O)N)Cl

InChI

InChI=1S/C16H19ClN2O6S2/c1-9(20)26-13-7-12(17)14(27(18,24)25)6-11(13)16(23)19(8-15(21)22)10-4-2-3-5-10/h6-7,10H,2-5,8H2,1H3,(H,21,22)(H2,18,24,25)