[8-(5,5-diethyl-7-phosphonooxy-heptoxy)-4,4-diethyl-octyl] dihydrogen phosphate

Systemtic Name: [8-(5,5-diethyl-7-phosphonooxy-heptoxy)-4,4-diethyl-octyl] dihydrogen phosphate Openeye Name: [8-(5,5-diethyl-7-phosphonooxy-heptoxy)-4,4-diethyl-octyl] dihydrogen phosphate CAS Name: [8-(5,5-diethyl-7-phosphonooxyheptoxy)-4,4-diethyloctyl] dihydrogen phosphate IUPAC Name: [8-(5,5-diethyl-7-phosphonooxyheptoxy)-4,4-diethyloctyl] dihydrogen phosphate Traditional Name: [8-(5,5-diethyl-7-phosphonooxy-heptoxy)-4,4-diethyl-octyl] dihydrogen phosphate Formula: C23H50O9P2 MolecularWeight: 532.585222

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCCCOCCCCC(CC)(CC)CCOP(=O)(O)O)CCCOP(=O)(O)O

Isomeric SMILES

CCC(CC)(CCCCOCCCCC(CC)(CC)CCOP(=O)(O)O)CCCOP(=O)(O)O

InChI

InChI=1S/C23H50O9P2/c1-5-22(6-2,16-13-20-31-33(24,25)26)14-9-11-18-30-19-12-10-15-23(7-3,8-4)17-21-32-34(27,28)29/h5-21H2,1-4H3,(H2,24,25,26)(H2,27,28,29)