2-azanyl-4-methoxy-5-sulfanyl-benzenesulfonic acid

Systemtic Name: 2-azanyl-4-methoxy-5-sulfanyl-benzenesulfonic acid Openeye Name: 2-amino-4-methoxy-5-sulfanyl-benzenesulfonic acid CAS Name: 2-amino-5-mercapto-4-methoxybenzenesulfonic acid IUPAC Name: 2-amino-4-methoxy-5-sulfanylbenzenesulfonic acid Traditional Name: 2-amino-5-mercapto-4-methoxy-besylic acid Formula: C7H9NO4S2 MolecularWeight: 235.28066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)N)S(=O)(=O)O)S

Isomeric SMILES

COC1=C(C=C(C(=C1)N)S(=O)(=O)O)S

InChI

InChI=1S/C7H9NO4S2/c1-12-5-2-4(8)7(3-6(5)13)14(9,10)11/h2-3,13H,8H2,1H3,(H,9,10,11)