[2,2-diethyl-6-(5-ethyl-5-phosphonooxy-heptoxy)hexyl] dihydrogen phosphate

Systemtic Name: [2,2-diethyl-6-(5-ethyl-5-phosphonooxy-heptoxy)hexyl] dihydrogen phosphate Openeye Name: [2,2-diethyl-6-(5-ethyl-5-phosphonooxy-heptoxy)hexyl] dihydrogen phosphate CAS Name: [2,2-diethyl-6-(5-ethyl-5-phosphonooxyheptoxy)hexyl] dihydrogen phosphate IUPAC Name: [2,2-diethyl-6-(5-ethyl-5-phosphonooxyheptoxy)hexyl] dihydrogen phosphate Traditional Name: [2,2-diethyl-6-(5-ethyl-5-phosphonooxy-heptoxy)hexyl] dihydrogen phosphate Formula: C19H42O9P2 MolecularWeight: 476.478902

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCCCOCCCCC(CC)(CC)OP(=O)(O)O)COP(=O)(O)O

Isomeric SMILES

CCC(CC)(CCCCOCCCCC(CC)(CC)OP(=O)(O)O)COP(=O)(O)O

InChI

InChI=1S/C19H42O9P2/c1-5-18(6-2,17-27-29(20,21)22)13-9-11-15-26-16-12-10-14-19(7-3,8-4)28-30(23,24)25/h5-17H2,1-4H3,(H2,20,21,22)(H2,23,24,25)