2-chloranyl-5-[(2,3-dimethoxyphenyl)methylamino]-3-sulfamoyl-benzoic acid

Systemtic Name: 2-chloranyl-5-[(2,3-dimethoxyphenyl)methylamino]-3-sulfamoyl-benzoic acid Openeye Name: 2-chloro-5-[(2,3-dimethoxyphenyl)methylamino]-3-sulfamoyl-benzoic acid CAS Name: 2-chloro-5-[(2,3-dimethoxyphenyl)methylamino]-3-sulfamoylbenzoic acid IUPAC Name: 2-chloro-5-[(2,3-dimethoxyphenyl)methylamino]-3-sulfamoylbenzoic acid Traditional Name: 2-chloro-5-(o-veratrylamino)-3-sulfamoyl-benzoic acid Formula: C16H17ClN2O6S MolecularWeight: 400.83398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CNC2=CC(=C(C(=C2)C(=O)O)Cl)S(=O)(=O)N

Isomeric SMILES

COC1=CC=CC(=C1OC)CNC2=CC(=C(C(=C2)C(=O)O)Cl)S(=O)(=O)N

InChI

InChI=1S/C16H17ClN2O6S/c1-24-12-5-3-4-9(15(12)25-2)8-19-10-6-11(16(20)21)14(17)13(7-10)26(18,22)23/h3-7,19H,8H2,1-2H3,(H,20,21)(H2,18,22,23)