2,3-dimethoxy-5-(prop-2-ynylsulfamoyl)benzoic acid

Systemtic Name: 2,3-dimethoxy-5-(prop-2-ynylsulfamoyl)benzoic acid Openeye Name: 2,3-dimethoxy-5-(prop-2-ynylsulfamoyl)benzoic acid CAS Name: 2,3-dimethoxy-5-(prop-2-ynylsulfamoyl)benzoic acid IUPAC Name: 2,3-dimethoxy-5-(prop-2-ynylsulfamoyl)benzoic acid Traditional Name: 2,3-dimethoxy-5-(propargylsulfamoyl)benzoic acid Formula: C12H13NO6S MolecularWeight: 299.29972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)S(=O)(=O)NCC#C)C(=O)O)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)S(=O)(=O)NCC#C)C(=O)O)OC

InChI

InChI=1S/C12H13NO6S/c1-4-5-13-20(16,17)8-6-9(12(14)15)11(19-3)10(7-8)18-2/h1,6-7,13H,5H2,2-3H3,(H,14,15)