1-[(4-sulfo-1,2,3-triazol-1-yl)methyl]-1,2,3-triazole-4-sulfonic acid

Systemtic Name: 1-[(4-sulfo-1,2,3-triazol-1-yl)methyl]-1,2,3-triazole-4-sulfonic acid Openeye Name: 1-[(4-sulfotriazol-1-yl)methyl]triazole-4-sulfonic acid CAS Name: 1-[(4-sulfo-1-triazolyl)methyl]-4-triazolesulfonic acid IUPAC Name: 1-[(4-sulfotriazol-1-yl)methyl]triazole-4-sulfonic acid Traditional Name: 1-[(4-sulfotriazol-1-yl)methyl]triazole-4-sulfonic acid Formula: C5H6N6O6S2 MolecularWeight: 310.26774

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=NN1CN2C=C(N=N2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=C(N=NN1CN2C=C(N=N2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C5H6N6O6S2/c12-18(13,14)4-1-10(8-6-4)3-11-2-5(7-9-11)19(15,16)17/h1-2H,3H2,(H,12,13,14)(H,15,16,17)