5-methyl-3-oxidanylidene-1H-pyrazole-2,4-disulfonic acid

Systemtic Name: 5-methyl-3-oxidanylidene-1H-pyrazole-2,4-disulfonic acid Openeye Name: 5-methyl-3-oxo-1H-pyrazole-2,4-disulfonic acid CAS Name: 5-methyl-3-oxo-1H-pyrazole-2,4-disulfonic acid IUPAC Name: 5-methyl-3-oxo-1H-pyrazole-2,4-disulfonic acid Traditional Name: 5-keto-3-methyl-3-pyrazoline-1,4-disulfonic acid Formula: C4H6N2O7S2 MolecularWeight: 258.22964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=C(C(=O)N(N1)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C4H6N2O7S2/c1-2-3(14(8,9)10)4(7)6(5-2)15(11,12)13/h5H,1H3,(H,8,9,10)(H,11,12,13)