tris[2-tert-butyl-6-[(3-tert-butyl-5-chloranyl-2-oxidanyl-phenyl)methyl]-4-chloranyl-phenyl] phosphate

Systemtic Name: tris[2-tert-butyl-6-[(3-tert-butyl-5-chloranyl-2-oxidanyl-phenyl)methyl]-4-chloranyl-phenyl] phosphate Openeye Name: tris[2-tert-butyl-6-[(3-tert-butyl-5-chloro-2-hydroxy-phenyl)methyl]-4-chloro-phenyl] phosphate CAS Name: phosphoric acid tris[2-tert-butyl-6-[(3-tert-butyl-5-chloro-2-hydroxyphenyl)methyl]-4-chlorophenyl] ester IUPAC Name: tris[2-tert-butyl-6-[(3-tert-butyl-5-chloro-2-hydroxyphenyl)methyl]-4-chlorophenyl] phosphate Traditional Name: phosphoric acid tris[2-tert-butyl-6-(3-tert-butyl-5-chloro-2-hydroxy-benzyl)-4-chloro-phenyl] ester Formula: C63H75Cl6O7P MolecularWeight: 1187.957161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=C1)Cl)CC2=CC(=CC(=C2OP(=O)(OC3=C(C=C(C=C3CC4=CC(=CC(=C4O)C(C)(C)C)Cl)Cl)C(C)(C)C)OC5=C(C=C(C=C5CC6=CC(=CC(=C6O)C(C)(C)C)Cl)Cl)C(C)(C)C)C(C)(C)C)Cl)O

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=C1)Cl)CC2=CC(=CC(=C2OP(=O)(OC3=C(C=C(C=C3CC4=CC(=CC(=C4O)C(C)(C)C)Cl)Cl)C(C)(C)C)OC5=C(C=C(C=C5CC6=CC(=CC(=C6O)C(C)(C)C)Cl)Cl)C(C)(C)C)C(C)(C)C)Cl)O

InChI

InChI=1S/C63H75Cl6O7P/c1-58(2,3)46-28-40(64)22-34(52(46)70)19-37-25-43(67)31-49(61(10,11)12)55(37)74-77(73,75-56-38(26-44(68)32-50(56)62(13,14)15)20-35-23-41(65)29-47(53(35)71)59(4,5)6)76-57-39(27-45(69)33-51(57)63(16,17)18)21-36-24-42(66)30-48(54(36)72)60(7,8)9/h22-33,70-72H,19-21H2,1-18H3