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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N

InChI

InChI=1S/C14H15N3O4S/c1-8-3-2-4-10(5-8)17-13-11(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)