bis[1,5-bis(3-tert-butyl-4-oxidanyl-phenyl)pentan-3-yl] butanedioate

Systemtic Name: bis[1,5-bis(3-tert-butyl-4-oxidanyl-phenyl)pentan-3-yl] butanedioate Openeye Name: bis[3-(3-tert-butyl-4-hydroxy-phenyl)-1-[2-(3-tert-butyl-4-hydroxy-phenyl)ethyl]propyl] butanedioate CAS Name: butanedioic acid bis[1,5-bis(3-tert-butyl-4-hydroxyphenyl)pentan-3-yl] ester IUPAC Name: bis[1,5-bis(3-tert-butyl-4-hydroxyphenyl)pentan-3-yl] butanedioate Traditional Name: succinic acid bis[3-(3-tert-butyl-4-hydroxy-phenyl)-1-[2-(3-tert-butyl-4-hydroxy-phenyl)ethyl]propyl] ester Formula: C54H74O8 MolecularWeight: 851.16056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)CCC(CCC2=CC(=C(C=C2)O)C(C)(C)C)OC(=O)CCC(=O)OC(CCC3=CC(=C(C=C3)O)C(C)(C)C)CCC4=CC(=C(C=C4)O)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)CCC(CCC2=CC(=C(C=C2)O)C(C)(C)C)OC(=O)CCC(=O)OC(CCC3=CC(=C(C=C3)O)C(C)(C)C)CCC4=CC(=C(C=C4)O)C(C)(C)C)O

InChI

InChI=1S/C54H74O8/c1-51(2,3)41-31-35(17-25-45(41)55)13-21-39(22-14-36-18-26-46(56)42(32-36)52(4,5)6)61-49(59)29-30-50(60)62-40(23-15-37-19-27-47(57)43(33-37)53(7,8)9)24-16-38-20-28-48(58)44(34-38)54(10,11)12/h17-20,25-28,31-34,39-40,55-58H,13-16,21-24,29-30H2,1-12H3