3-chloranyl-5-methoxy-4-(4-sulfamoylphenyl)sulfonyloxy-benzoic acid

Systemtic Name: 3-chloranyl-5-methoxy-4-(4-sulfamoylphenyl)sulfonyloxy-benzoic acid Openeye Name: 3-chloro-5-methoxy-4-(4-sulfamoylphenyl)sulfonyloxy-benzoic acid CAS Name: 3-chloro-5-methoxy-4-(4-sulfamoylphenyl)sulfonyloxybenzoic acid IUPAC Name: 3-chloro-5-methoxy-4-(4-sulfamoylphenyl)sulfonyloxybenzoic acid Traditional Name: 3-chloro-5-methoxy-4-(4-sulfamoylphenyl)sulfonyloxy-benzoic acid Formula: C14H12ClNO8S2 MolecularWeight: 421.82998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C14H12ClNO8S2/c1-23-12-7-8(14(17)18)6-11(15)13(12)24-26(21,22)10-4-2-9(3-5-10)25(16,19)20/h2-7H,1H3,(H,17,18)(H2,16,19,20)