octadecyl 3-[acetyloxy-(2,6-ditert-butyl-3-octadecoxycarbonyl-4-pentyl-phenoxy)phosphanyl]oxy-2,4-ditert-butyl-6-pentyl-benzoate

Systemtic Name: octadecyl 3-[acetyloxy-(2,6-ditert-butyl-3-octadecoxycarbonyl-4-pentyl-phenoxy)phosphanyl]oxy-2,4-ditert-butyl-6-pentyl-benzoate Openeye Name: octadecyl 3-[acetoxy-(2,6-ditert-butyl-3-octadecoxycarbonyl-4-pentyl-phenoxy)phosphanyl]oxy-2,4-ditert-butyl-6-pentyl-benzoate CAS Name: 3-[acetyloxy-[2,6-ditert-butyl-3-[octadecoxy(oxo)methyl]-4-pentylphenoxy]phosphino]oxy-2,4-ditert-butyl-6-pentylbenzoic acid octadecyl ester IUPAC Name: octadecyl 3-[acetyloxy-(2,6-ditert-butyl-3-octadecoxycarbonyl-4-pentylphenoxy)phosphanyl]oxy-2,4-ditert-butyl-6-pentylbenzoate Traditional Name: 3-[acetoxy-(4-amyl-2,6-ditert-butyl-3-stearyloxycarbonyl-phenoxy)phosphino]oxy-6-amyl-2,4-ditert-butyl-benzoic acid stearyl ester Formula: C78H137O8P MolecularWeight: 1233.891341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=C(C(=C(C=C1CCCCC)C(C)(C)C)OP(OC2=C(C=C(C(=C2C(C)(C)C)C(=O)OCCCCCCCCCCCCCCCCCC)CCCCC)C(C)(C)C)OC(=O)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=C(C(=C(C=C1CCCCC)C(C)(C)C)OP(OC2=C(C=C(C(=C2C(C)(C)C)C(=O)OCCCCCCCCCCCCCCCCCC)CCCCC)C(C)(C)C)OC(=O)C)C(C)(C)C

InChI

InChI=1S/C78H137O8P/c1-18-22-26-28-30-32-34-36-38-40-42-44-46-48-50-54-58-82-73(80)67-63(56-52-24-20-3)60-65(75(6,7)8)71(69(67)77(12,13)14)85-87(84-62(5)79)86-72-66(76(9,10)11)61-64(57-53-25-21-4)68(70(72)78(15,16)17)74(81)83-59-55-51-49-47-45-43-41-39-37-35-33-31-29-27-23-19-2/h60-61H,18-59H2,1-17H3