8-(5,5-diethyl-9-phosphonooxy-nonoxy)-4,4-diethyl-octanoic acid

Systemtic Name: 8-(5,5-diethyl-9-phosphonooxy-nonoxy)-4,4-diethyl-octanoic acid Openeye Name: 8-(5,5-diethyl-9-phosphonooxy-nonoxy)-4,4-diethyl-octanoic acid CAS Name: 8-(5,5-diethyl-9-phosphonooxynonoxy)-4,4-diethyloctanoic acid IUPAC Name: 8-(5,5-diethyl-9-phosphonooxynonoxy)-4,4-diethyloctanoic acid Traditional Name: 8-(5,5-diethyl-9-phosphonooxy-nonoxy)-4,4-diethyl-caprylic acid Formula: C25H51O7P MolecularWeight: 494.642001

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H51O7P/c1-5-24(6-2,17-11-14-22-32-33(28,29)30)16-9-12-20-31-21-13-10-18-25(7-3,8-4)19-15-23(26)27/h5-22H2,1-4H3,(H,26,27)(H2,28,29,30)