(5-methyl-1-phosphonooxy-heptan-4-yl) dihydrogen phosphate

Systemtic Name: (5-methyl-1-phosphonooxy-heptan-4-yl) dihydrogen phosphate Openeye Name: (5-methyl-4-phosphonooxy-heptyl) dihydrogen phosphate CAS Name: (5-methyl-1-phosphonooxyheptan-4-yl) dihydrogen phosphate IUPAC Name: (5-methyl-1-phosphonooxyheptan-4-yl) dihydrogen phosphate Traditional Name: (5-methyl-4-phosphonooxy-heptyl) dihydrogen phosphate Formula: C8H20O8P2 MolecularWeight: 306.187122

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CCCOP(=O)(O)O)OP(=O)(O)O

Isomeric SMILES

CCC(C)C(CCCOP(=O)(O)O)OP(=O)(O)O

InChI

InChI=1S/C8H20O8P2/c1-3-7(2)8(16-18(12,13)14)5-4-6-15-17(9,10)11/h7-8H,3-6H2,1-2H3,(H2,9,10,11)(H2,12,13,14)