4-chloranyl-3-nitro-5-sulfamoyl-benzoic acid

Systemtic Name: 4-chloranyl-3-nitro-5-sulfamoyl-benzoic acid Openeye Name: 4-chloro-3-nitro-5-sulfamoyl-benzoic acid CAS Name: 4-chloro-3-nitro-5-sulfamoylbenzoic acid IUPAC Name: 4-chloro-3-nitro-5-sulfamoylbenzoic acid Traditional Name: 4-chloro-3-nitro-5-sulfamoyl-benzoic acid Formula: C7H5ClN2O6S MolecularWeight: 280.6424

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])Cl)S(=O)(=O)N)C(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])Cl)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C7H5ClN2O6S/c8-6-4(10(13)14)1-3(7(11)12)2-5(6)17(9,15)16/h1-2H,(H,11,12)(H2,9,15,16)