2-azanyl-3-methoxy-6-(sulfanylmethyl)benzenesulfonic acid

Systemtic Name: 2-azanyl-3-methoxy-6-(sulfanylmethyl)benzenesulfonic acid Openeye Name: 2-amino-3-methoxy-6-(sulfanylmethyl)benzenesulfonic acid CAS Name: 2-amino-6-(mercaptomethyl)-3-methoxybenzenesulfonic acid IUPAC Name: 2-amino-3-methoxy-6-(sulfanylmethyl)benzenesulfonic acid Traditional Name: 2-amino-6-(mercaptomethyl)-3-methoxy-besylic acid Formula: C8H11NO4S2 MolecularWeight: 249.30724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11NO4S2/c1-13-6-3-2-5(4-14)8(7(6)9)15(10,11)12/h2-3,14H,4,9H2,1H3,(H,10,11,12)