[3-(2,2-dimethylpropanoyl)-5-phosphono-1,4-dihydropyrazol-5-yl]phosphonic acid

Systemtic Name: [3-(2,2-dimethylpropanoyl)-5-phosphono-1,4-dihydropyrazol-5-yl]phosphonic acid Openeye Name: [3-(2,2-dimethylpropanoyl)-5-phosphono-1,4-dihydropyrazol-5-yl]phosphonic acid CAS Name: [3-(2,2-dimethyl-1-oxopropyl)-5-phosphono-1,4-dihydropyrazol-5-yl]phosphonic acid IUPAC Name: [3-(2,2-dimethylpropanoyl)-5-phosphono-1,4-dihydropyrazol-5-yl]phosphonic acid Traditional Name: (3-phosphono-5-pivaloyl-2-pyrazolin-3-yl)phosphonic acid Formula: C8H16N2O7P2 MolecularWeight: 314.169362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=NNC(C1)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC(C)(C)C(=O)C1=NNC(C1)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C8H16N2O7P2/c1-7(2,3)6(11)5-4-8(10-9-5,18(12,13)14)19(15,16)17/h10H,4H2,1-3H3,(H2,12,13,14)(H2,15,16,17)