2-[(2,6-dimethyl-3-sulfamoyl-phenyl)amino]benzoic acid

Systemtic Name: 2-[(2,6-dimethyl-3-sulfamoyl-phenyl)amino]benzoic acid Openeye Name: 2-(2,6-dimethyl-3-sulfamoyl-anilino)benzoic acid CAS Name: 2-(2,6-dimethyl-3-sulfamoylanilino)benzoic acid IUPAC Name: 2-(2,6-dimethyl-3-sulfamoylanilino)benzoic acid Traditional Name: 2-(2,6-dimethyl-3-sulfamoyl-anilino)benzoic acid Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)N)C)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)N)C)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H16N2O4S/c1-9-7-8-13(22(16,20)21)10(2)14(9)17-12-6-4-3-5-11(12)15(18)19/h3-8,17H,1-2H3,(H,18,19)(H2,16,20,21)