hexyl 5-[4-(4-diethoxyphosphoryl-2-methyl-butan-2-yl)-2,5-bis(oxidanyl)phenyl]-5-methyl-hexanoate

Systemtic Name: hexyl 5-[4-(4-diethoxyphosphoryl-2-methyl-butan-2-yl)-2,5-bis(oxidanyl)phenyl]-5-methyl-hexanoate Openeye Name: hexyl 5-[4-(3-diethoxyphosphoryl-1,1-dimethyl-propyl)-2,5-dihydroxy-phenyl]-5-methyl-hexanoate CAS Name: 5-[4-(4-diethoxyphosphoryl-2-methylbutan-2-yl)-2,5-dihydroxyphenyl]-5-methylhexanoic acid hexyl ester IUPAC Name: hexyl 5-[4-(4-diethoxyphosphoryl-2-methylbutan-2-yl)-2,5-dihydroxyphenyl]-5-methylhexanoate Traditional Name: 5-[4-(3-diethoxyphosphoryl-1,1-dimethyl-propyl)-2,5-dihydroxy-phenyl]-5-methyl-hexanoic acid hexyl ester Formula: C28H49O7P MolecularWeight: 528.658221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCC(C)(C)C1=CC(=C(C=C1O)C(C)(C)CCP(=O)(OCC)OCC)O

Isomeric SMILES

CCCCCCOC(=O)CCCC(C)(C)C1=CC(=C(C=C1O)C(C)(C)CCP(=O)(OCC)OCC)O

InChI

InChI=1S/C28H49O7P/c1-8-11-12-13-18-33-26(31)15-14-16-27(4,5)22-20-25(30)23(21-24(22)29)28(6,7)17-19-36(32,34-9-2)35-10-3/h20-21,29-30H,8-19H2,1-7H3