phosphono (3,4,4-triethyl-6-oxidanyl-hexan-3-yl) hydrogen phosphate

Systemtic Name: phosphono (3,4,4-triethyl-6-oxidanyl-hexan-3-yl) hydrogen phosphate Openeye Name: phosphono (1,1,2,2-tetraethyl-4-hydroxy-butyl) hydrogen phosphate CAS Name: phosphono (3,4,4-triethyl-6-hydroxyhexan-3-yl) hydrogen phosphate IUPAC Name: phosphono (3,4,4-triethyl-6-hydroxyhexan-3-yl) hydrogen phosphate Traditional Name: phosphono (1,1,2,2-tetraethyl-4-hydroxy-butyl) hydrogen phosphate Formula: C12H28O8P2 MolecularWeight: 362.293442

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCO)C(CC)(CC)OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

CCC(CC)(CCO)C(CC)(CC)OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C12H28O8P2/c1-5-11(6-2,9-10-13)12(7-3,8-4)19-22(17,18)20-21(14,15)16/h13H,5-10H2,1-4H3,(H,17,18)(H2,14,15,16)