5-[3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)propanoyloxy]-4,4-bis[3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)propanoyloxymethyl]pentanoate

Systemtic Name: 5-[3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)propanoyloxy]-4,4-bis[3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)propanoyloxymethyl]pentanoate Openeye Name: 5-[3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)propanoyloxy]-4,4-bis[3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)propanoyloxymethyl]pentanoate CAS Name: 5-[3-(3-tert-butyl-4-hydroxy-5-methylphenyl)-1-oxopropoxy]-4,4-bis[[3-(3-tert-butyl-4-hydroxy-5-methylphenyl)-1-oxopropoxy]methyl]pentanoate IUPAC Name: 5-[3-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanoyloxy]-4,4-bis[3-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanoyloxymethyl]pentanoate Traditional Name: 5-[3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)propanoyloxy]-4,4-bis[3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)propanoyloxymethyl]valerate Formula: C49H67O11- MolecularWeight: 832.04968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CCC(=O)OCC(CCC(=O)[O-])(COC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C)COC(=O)CCC3=CC(=C(C(=C3)C(C)(C)C)O)C)C(C)(C)C)O

Isomeric SMILES

CC1=C(C(=CC(=C1)CCC(=O)OCC(CCC(=O)[O-])(COC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C)COC(=O)CCC3=CC(=C(C(=C3)C(C)(C)C)O)C)C(C)(C)C)O

InChI

InChI=1S/C49H68O11/c1-30-21-33(24-36(43(30)55)46(4,5)6)13-16-40(52)58-27-49(20-19-39(50)51,28-59-41(53)17-14-34-22-31(2)44(56)37(25-34)47(7,8)9)29-60-42(54)18-15-35-23-32(3)45(57)38(26-35)48(10,11)12/h21-26,55-57H,13-20,27-29H2,1-12H3,(H,50,51)/p-1