tris[1,5-bis(3,5-ditert-butyl-4-oxidanyl-phenyl)pentan-3-yl] phosphite

Systemtic Name: tris[1,5-bis(3,5-ditert-butyl-4-oxidanyl-phenyl)pentan-3-yl] phosphite Openeye Name: tris[3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]propyl] phosphite CAS Name: phosphorous acid tris[1,5-bis(3,5-ditert-butyl-4-hydroxyphenyl)pentan-3-yl] ester IUPAC Name: tris[1,5-bis(3,5-ditert-butyl-4-hydroxyphenyl)pentan-3-yl] phosphite Traditional Name: phosphorous acid tris[3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]propyl] ester Formula: C99H153O9P MolecularWeight: 1518.242481

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)OP(OC(CCC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)CCC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C)OC(CCC5=CC(=C(C(=C5)C(C)(C)C)O)C(C)(C)C)CCC6=CC(=C(C(=C6)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)OP(OC(CCC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)CCC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C)OC(CCC5=CC(=C(C(=C5)C(C)(C)C)O)C(C)(C)C)CCC6=CC(=C(C(=C6)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C99H153O9P/c1-88(2,3)70-49-61(50-71(82(70)100)89(4,5)6)37-43-67(44-38-62-51-72(90(7,8)9)83(101)73(52-62)91(10,11)12)106-109(107-68(45-39-63-53-74(92(13,14)15)84(102)75(54-63)93(16,17)18)46-40-64-55-76(94(19,20)21)85(103)77(56-64)95(22,23)24)108-69(47-41-65-57-78(96(25,26)27)86(104)79(58-65)97(28,29)30)48-42-66-59-80(98(31,32)33)87(105)81(60-66)99(34,35)36/h49-60,67-69,100-105H,37-48H2,1-36H3