diethoxyphosphorylmethyl 1H-1,2,4-triazole-5-sulfonate

Systemtic Name: diethoxyphosphorylmethyl 1H-1,2,4-triazole-5-sulfonate Openeye Name: diethoxyphosphorylmethyl 1H-1,2,4-triazole-5-sulfonate CAS Name: 1H-1,2,4-triazole-5-sulfonic acid diethoxyphosphorylmethyl ester IUPAC Name: diethoxyphosphorylmethyl 1H-1,2,4-triazole-5-sulfonate Traditional Name: 1H-1,2,4-triazole-5-sulfonic acid diethoxyphosphorylmethyl ester Formula: C7H14N3O6PS MolecularWeight: 299.241321

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(COS(=O)(=O)C1=NC=NN1)OCC

Isomeric SMILES

CCOP(=O)(COS(=O)(=O)C1=NC=NN1)OCC

InChI

InChI=1S/C7H14N3O6PS/c1-3-14-17(11,15-4-2)6-16-18(12,13)7-8-5-9-10-7/h5H,3-4,6H2,1-2H3,(H,8,9,10)