8-(5,5-diethyl-7-phosphonooxy-heptoxy)-4,4-diethyl-octanoic acid

Systemtic Name: 8-(5,5-diethyl-7-phosphonooxy-heptoxy)-4,4-diethyl-octanoic acid Openeye Name: 8-(5,5-diethyl-7-phosphonooxy-heptoxy)-4,4-diethyl-octanoic acid CAS Name: 8-(5,5-diethyl-7-phosphonooxyheptoxy)-4,4-diethyloctanoic acid IUPAC Name: 8-(5,5-diethyl-7-phosphonooxyheptoxy)-4,4-diethyloctanoic acid Traditional Name: 8-(5,5-diethyl-7-phosphonooxy-heptoxy)-4,4-diethyl-caprylic acid Formula: C23H47O7P MolecularWeight: 466.588841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H47O7P/c1-5-22(6-2,16-13-21(24)25)14-9-11-18-29-19-12-10-15-23(7-3,8-4)17-20-30-31(26,27)28/h5-20H2,1-4H3,(H,24,25)(H2,26,27,28)