sodium 6-[(4-chloranyl-2-fluoranyl-phenyl)sulfamoyl]cyclohexene-1-carboxylate

Systemtic Name: sodium 6-[(4-chloranyl-2-fluoranyl-phenyl)sulfamoyl]cyclohexene-1-carboxylate Openeye Name: sodium 6-[(4-chloro-2-fluoro-phenyl)sulfamoyl]cyclohexene-1-carboxylate CAS Name: sodium 6-[(4-chloro-2-fluorophenyl)sulfamoyl]-1-cyclohexenecarboxylate IUPAC Name: sodium 6-[(4-chloro-2-fluorophenyl)sulfamoyl]cyclohexene-1-carboxylate Traditional Name: sodium 6-[(4-chloro-2-fluoro-phenyl)sulfamoyl]cyclohexene-1-carboxylate Formula: C13H12ClFNNaO4S MolecularWeight: 355.744853

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C(C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)F)C(=O)[O-].[Na+]

Isomeric SMILES

C1CC=C(C(C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)F)C(=O)[O-].[Na+]

InChI

InChI=1S/C13H13ClFNO4S.Na/c14-8-5-6-11(10(15)7-8)16-21(19,20)12-4-2-1-3-9(12)13(17)18;/h3,5-7,12,16H,1-2,4H2,(H,17,18);/q;+1/p-1