[5,5-diethyl-9-(5-ethyl-5-phosphonooxy-heptoxy)nonyl] dihydrogen phosphate

Systemtic Name: [5,5-diethyl-9-(5-ethyl-5-phosphonooxy-heptoxy)nonyl] dihydrogen phosphate Openeye Name: [5,5-diethyl-9-(5-ethyl-5-phosphonooxy-heptoxy)nonyl] dihydrogen phosphate CAS Name: [5,5-diethyl-9-(5-ethyl-5-phosphonooxyheptoxy)nonyl] dihydrogen phosphate IUPAC Name: [5,5-diethyl-9-(5-ethyl-5-phosphonooxyheptoxy)nonyl] dihydrogen phosphate Traditional Name: [5,5-diethyl-9-(5-ethyl-5-phosphonooxy-heptoxy)nonyl] dihydrogen phosphate Formula: C22H48O9P2 MolecularWeight: 518.558642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H48O9P2/c1-5-21(6-2,16-10-14-20-30-32(23,24)25)15-9-12-18-29-19-13-11-17-22(7-3,8-4)31-33(26,27)28/h5-20H2,1-4H3,(H2,23,24,25)(H2,26,27,28)