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

Systemtic Name: hexyl 5-[4-(4-diethoxyphosphoryl-2-methyl-butan-2-yl)-5-methoxy-2-oxidanyl-phenyl]-5-methyl-hexanoate Openeye Name: hexyl 5-[4-(3-diethoxyphosphoryl-1,1-dimethyl-propyl)-2-hydroxy-5-methoxy-phenyl]-5-methyl-hexanoate CAS Name: 5-[4-(4-diethoxyphosphoryl-2-methylbutan-2-yl)-2-hydroxy-5-methoxyphenyl]-5-methylhexanoic acid hexyl ester IUPAC Name: hexyl 5-[4-(4-diethoxyphosphoryl-2-methylbutan-2-yl)-2-hydroxy-5-methoxyphenyl]-5-methylhexanoate Traditional Name: 5-[4-(3-diethoxyphosphoryl-1,1-dimethyl-propyl)-2-hydroxy-5-methoxy-phenyl]-5-methyl-hexanoic acid hexyl ester Formula: C29H51O7P MolecularWeight: 542.684801

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCC(C)(C)C1=C(C=C(C(=C1)OC)C(C)(C)CCP(=O)(OCC)OCC)O

Isomeric SMILES

CCCCCCOC(=O)CCCC(C)(C)C1=C(C=C(C(=C1)OC)C(C)(C)CCP(=O)(OCC)OCC)O

InChI

InChI=1S/C29H51O7P/c1-9-12-13-14-19-34-27(31)16-15-17-28(4,5)23-22-26(33-8)24(21-25(23)30)29(6,7)18-20-37(32,35-10-2)36-11-3/h21-22,30H,9-20H2,1-8H3