3-azanyl-4-[(2-methylphenyl)amino]-5-sulfamoyl-benzoic acid

Systemtic Name: 3-azanyl-4-[(2-methylphenyl)amino]-5-sulfamoyl-benzoic acid Openeye Name: 3-amino-4-(2-methylanilino)-5-sulfamoyl-benzoic acid CAS Name: 3-amino-4-(2-methylanilino)-5-sulfamoylbenzoic acid IUPAC Name: 3-amino-4-(2-methylanilino)-5-sulfamoylbenzoic acid Traditional Name: 3-amino-4-(o-toluidino)-5-sulfamoyl-benzoic acid Formula: C14H15N3O4S MolecularWeight: 321.3516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N

Isomeric SMILES

CC1=CC=CC=C1NC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N

InChI

InChI=1S/C14H15N3O4S/c1-8-4-2-3-5-11(8)17-13-10(15)6-9(14(18)19)7-12(13)22(16,20)21/h2-7,17H,15H2,1H3,(H,18,19)(H2,16,20,21)