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

Systemtic Name: 1-[4-(4-sulfo-1,2,3-triazol-1-yl)butyl]-1,2,3-triazole-4-sulfonic acid Openeye Name: 1-[4-(4-sulfotriazol-1-yl)butyl]triazole-4-sulfonic acid CAS Name: 1-[4-(4-sulfo-1-triazolyl)butyl]-4-triazolesulfonic acid IUPAC Name: 1-[4-(4-sulfotriazol-1-yl)butyl]triazole-4-sulfonic acid Traditional Name: 1-[4-(4-sulfotriazol-1-yl)butyl]triazole-4-sulfonic acid Formula: C8H12N6O6S2 MolecularWeight: 352.34748

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=NN1CCCCN2C=C(N=N2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=C(N=NN1CCCCN2C=C(N=N2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C8H12N6O6S2/c15-21(16,17)7-5-13(11-9-7)3-1-2-4-14-6-8(10-12-14)22(18,19)20/h5-6H,1-4H2,(H,15,16,17)(H,18,19,20)