2-(5-aminocarbonyl-3-oxidanylidene-1H-pyrazol-2-yl)benzene-1,4-disulfonic acid

Systemtic Name: 2-(5-aminocarbonyl-3-oxidanylidene-1H-pyrazol-2-yl)benzene-1,4-disulfonic acid Openeye Name: 2-(5-carbamoyl-3-oxo-1H-pyrazol-2-yl)benzene-1,4-disulfonic acid CAS Name: 2-(5-carbamoyl-3-oxo-1H-pyrazol-2-yl)benzene-1,4-disulfonic acid IUPAC Name: 2-(5-carbamoyl-3-oxo-1H-pyrazol-2-yl)benzene-1,4-disulfonic acid Traditional Name: 2-(3-carbamoyl-5-keto-3-pyrazolin-1-yl)benzene-1,4-disulfonic acid Formula: C10H9N3O8S2 MolecularWeight: 363.32376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)O)N2C(=O)C=C(N2)C(=O)N)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)O)N2C(=O)C=C(N2)C(=O)N)S(=O)(=O)O

InChI

InChI=1S/C10H9N3O8S2/c11-10(15)6-4-9(14)13(12-6)7-3-5(22(16,17)18)1-2-8(7)23(19,20)21/h1-4,12H,(H2,11,15)(H,16,17,18)(H,19,20,21)