5-(4-azanyl-1,2,3-triazin-5-yl)benzene-1,3-disulfonic acid

Systemtic Name: 5-(4-azanyl-1,2,3-triazin-5-yl)benzene-1,3-disulfonic acid Openeye Name: 5-(4-aminotriazin-5-yl)benzene-1,3-disulfonic acid CAS Name: 5-(4-amino-5-triazinyl)benzene-1,3-disulfonic acid IUPAC Name: 5-(4-aminotriazin-5-yl)benzene-1,3-disulfonic acid Traditional Name: 5-(4-aminotriazin-5-yl)benzene-1,3-disulfonic acid Formula: C9H8N4O6S2 MolecularWeight: 332.31302

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1S(=O)(=O)O)S(=O)(=O)O)C2=CN=NN=C2N

Isomeric SMILES

C1=C(C=C(C=C1S(=O)(=O)O)S(=O)(=O)O)C2=CN=NN=C2N

InChI

InChI=1S/C9H8N4O6S2/c10-9-8(4-11-13-12-9)5-1-6(20(14,15)16)3-7(2-5)21(17,18)19/h1-4H,(H2,10,11,12)(H,14,15,16)(H,17,18,19)