3-azanyl-4-(3,5-dimethylphenoxy)-5-sulfamoyl-benzoic acid

Systemtic Name: 3-azanyl-4-(3,5-dimethylphenoxy)-5-sulfamoyl-benzoic acid Openeye Name: 3-amino-4-(3,5-dimethylphenoxy)-5-sulfamoyl-benzoic acid CAS Name: 3-amino-4-(3,5-dimethylphenoxy)-5-sulfamoylbenzoic acid IUPAC Name: 3-amino-4-(3,5-dimethylphenoxy)-5-sulfamoylbenzoic acid Traditional Name: 3-amino-4-(3,5-dimethylphenoxy)-5-sulfamoyl-benzoic acid Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N)C

InChI

InChI=1S/C15H16N2O5S/c1-8-3-9(2)5-11(4-8)22-14-12(16)6-10(15(18)19)7-13(14)23(17,20)21/h3-7H,16H2,1-2H3,(H,18,19)(H2,17,20,21)