4-[(3-azanyl-4-methyl-phenyl)sulfonylamino]benzenesulfonic acid

Systemtic Name: 4-[(3-azanyl-4-methyl-phenyl)sulfonylamino]benzenesulfonic acid Openeye Name: 4-[(3-amino-4-methyl-phenyl)sulfonylamino]benzenesulfonic acid CAS Name: 4-[(3-amino-4-methylphenyl)sulfonylamino]benzenesulfonic acid IUPAC Name: 4-[(3-amino-4-methylphenyl)sulfonylamino]benzenesulfonic acid Traditional Name: 4-[(3-amino-4-methyl-phenyl)sulfonylamino]besylic acid Formula: C13H14N2O5S2 MolecularWeight: 342.39066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)O)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)O)N

InChI

InChI=1S/C13H14N2O5S2/c1-9-2-5-12(8-13(9)14)21(16,17)15-10-3-6-11(7-4-10)22(18,19)20/h2-8,15H,14H2,1H3,(H,18,19,20)