3-[(3,4-dimethoxyphenyl)sulfonylamino]-1H-1,2,4-triazole-5-carboxylic acid

Systemtic Name: 3-[(3,4-dimethoxyphenyl)sulfonylamino]-1H-1,2,4-triazole-5-carboxylic acid Openeye Name: 3-[(3,4-dimethoxyphenyl)sulfonylamino]-1H-1,2,4-triazole-5-carboxylic acid CAS Name: 3-[(3,4-dimethoxyphenyl)sulfonylamino]-1H-1,2,4-triazole-5-carboxylic acid IUPAC Name: 3-[(3,4-dimethoxyphenyl)sulfonylamino]-1H-1,2,4-triazole-5-carboxylic acid Traditional Name: 3-[(3,4-dimethoxyphenyl)sulfonylamino]-1H-1,2,4-triazole-5-carboxylic acid Formula: C11H12N4O6S MolecularWeight: 328.30118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=NNC(=N2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=NNC(=N2)C(=O)O)OC

InChI

InChI=1S/C11H12N4O6S/c1-20-7-4-3-6(5-8(7)21-2)22(18,19)15-11-12-9(10(16)17)13-14-11/h3-5H,1-2H3,(H,16,17)(H2,12,13,14,15)