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

Systemtic Name: 2-azanyl-5-(5-carboxyoxy-3-oxidanylidene-1H-pyrazol-2-yl)benzene-1,4-disulfonic acid Openeye Name: 2-amino-5-(5-carboxyoxy-3-oxo-1H-pyrazol-2-yl)benzene-1,4-disulfonic acid CAS Name: 2-amino-5-(5-carboxyoxy-3-oxo-1H-pyrazol-2-yl)benzene-1,4-disulfonic acid IUPAC Name: 2-amino-5-(5-carboxyoxy-3-oxo-1H-pyrazol-2-yl)benzene-1,4-disulfonic acid Traditional Name: 2-amino-5-(3-carboxyoxy-5-keto-3-pyrazolin-1-yl)benzene-1,4-disulfonic acid Formula: C10H9N3O10S2 MolecularWeight: 395.32256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9N3O10S2/c11-4-1-7(25(20,21)22)5(2-6(4)24(17,18)19)13-9(14)3-8(12-13)23-10(15)16/h1-3,12H,11H2,(H,15,16)(H,17,18,19)(H,20,21,22)