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

Systemtic Name: 3-[(3-azanyl-4-methoxy-phenyl)sulfonylamino]benzenesulfonic acid Openeye Name: 3-[(3-amino-4-methoxy-phenyl)sulfonylamino]benzenesulfonic acid CAS Name: 3-[(3-amino-4-methoxyphenyl)sulfonylamino]benzenesulfonic acid IUPAC Name: 3-[(3-amino-4-methoxyphenyl)sulfonylamino]benzenesulfonic acid Traditional Name: 3-[(3-amino-4-methoxy-phenyl)sulfonylamino]besylic acid Formula: C13H14N2O6S2 MolecularWeight: 358.39006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)O)N

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)O)N

InChI

InChI=1S/C13H14N2O6S2/c1-21-13-6-5-10(8-12(13)14)22(16,17)15-9-3-2-4-11(7-9)23(18,19)20/h2-8,15H,14H2,1H3,(H,18,19,20)