2-(5-azanyl-4-cyano-pyrazol-1-yl)benzene-1,4-disulfonic acid

Systemtic Name: 2-(5-azanyl-4-cyano-pyrazol-1-yl)benzene-1,4-disulfonic acid Openeye Name: 2-(5-amino-4-cyano-pyrazol-1-yl)benzene-1,4-disulfonic acid CAS Name: 2-(5-amino-4-cyano-1-pyrazolyl)benzene-1,4-disulfonic acid IUPAC Name: 2-(5-amino-4-cyanopyrazol-1-yl)benzene-1,4-disulfonic acid Traditional Name: 2-(5-amino-4-cyano-pyrazol-1-yl)benzene-1,4-disulfonic acid Formula: C10H8N4O6S2 MolecularWeight: 344.32372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H8N4O6S2/c11-4-6-5-13-14(10(6)12)8-3-7(21(15,16)17)1-2-9(8)22(18,19)20/h1-3,5H,12H2,(H,15,16,17)(H,18,19,20)