4-chloranyl-2-cyano-5-sulfamoyl-benzoic acid

Systemtic Name: 4-chloranyl-2-cyano-5-sulfamoyl-benzoic acid Openeye Name: 4-chloro-2-cyano-5-sulfamoyl-benzoic acid CAS Name: 4-chloro-2-cyano-5-sulfamoylbenzoic acid IUPAC Name: 4-chloro-2-cyano-5-sulfamoylbenzoic acid Traditional Name: 4-chloro-2-cyano-5-sulfamoyl-benzoic acid Formula: C8H5ClN2O4S MolecularWeight: 260.6543

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1Cl)S(=O)(=O)N)C(=O)O)C#N

Isomeric SMILES

C1=C(C(=CC(=C1Cl)S(=O)(=O)N)C(=O)O)C#N

InChI

InChI=1S/C8H5ClN2O4S/c9-6-1-4(3-10)5(8(12)13)2-7(6)16(11,14)15/h1-2H,(H,12,13)(H2,11,14,15)