4-[aminocarbonyl-(4-methylphenyl)amino]-2-azanyl-benzenesulfonic acid

Systemtic Name: 4-[aminocarbonyl-(4-methylphenyl)amino]-2-azanyl-benzenesulfonic acid Openeye Name: 2-amino-4-(N-carbamoyl-4-methyl-anilino)benzenesulfonic acid CAS Name: 2-amino-4-(N-carbamoyl-4-methylanilino)benzenesulfonic acid IUPAC Name: 2-amino-4-(N-carbamoyl-4-methylanilino)benzenesulfonic acid Traditional Name: 2-amino-4-(N-carbamoyl-4-methyl-anilino)besylic acid Formula: C14H15N3O4S MolecularWeight: 321.3516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=CC(=C(C=C2)S(=O)(=O)O)N)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=CC(=C(C=C2)S(=O)(=O)O)N)C(=O)N

InChI

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