tris(2,4-ditert-butylphenoxy)-dioctadecyl-$l^{5}-phosphane

Systemtic Name: tris(2,4-ditert-butylphenoxy)-dioctadecyl-$l^{5}-phosphane Openeye Name: tris(2,4-ditert-butylphenoxy)-dioctadecyl-$l^{5}-phosphane CAS Name: tris(2,4-ditert-butylphenoxy)-dioctadecylphosphorane IUPAC Name: tris(2,4-ditert-butylphenoxy)-dioctadecyl-$l^{5}-phosphane Traditional Name: tris(2,4-ditert-butylphenoxy)-distearyl-phosphorane Formula: C78H137O3P MolecularWeight: 1153.894341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCP(CCCCCCCCCCCCCCCCCC)(OC1=C(C=C(C=C1)C(C)(C)C)C(C)(C)C)(OC2=C(C=C(C=C2)C(C)(C)C)C(C)(C)C)OC3=C(C=C(C=C3)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCP(CCCCCCCCCCCCCCCCCC)(OC1=C(C=C(C=C1)C(C)(C)C)C(C)(C)C)(OC2=C(C=C(C=C2)C(C)(C)C)C(C)(C)C)OC3=C(C=C(C=C3)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C78H137O3P/c1-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-59-82(79-70-56-53-64(73(3,4)5)61-67(70)76(12,13)14,80-71-57-54-65(74(6,7)8)62-68(71)77(15,16)17,81-72-58-55-66(75(9,10)11)63-69(72)78(18,19)20)60-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-2/h53-58,61-63H,21-52,59-60H2,1-20H3