bis[6-(3,5-ditert-butyl-4-oxidanyl-phenyl)hexyl] benzene-1,3-dicarboxylate

Systemtic Name: bis[6-(3,5-ditert-butyl-4-oxidanyl-phenyl)hexyl] benzene-1,3-dicarboxylate Openeye Name: bis[6-(3,5-ditert-butyl-4-hydroxy-phenyl)hexyl] benzene-1,3-dicarboxylate CAS Name: benzene-1,3-dicarboxylic acid bis[6-(3,5-ditert-butyl-4-hydroxyphenyl)hexyl] ester IUPAC Name: bis[6-(3,5-ditert-butyl-4-hydroxyphenyl)hexyl] benzene-1,3-dicarboxylate Traditional Name: benzene-1,3-dicarboxylic acid bis[6-(3,5-ditert-butyl-4-hydroxy-phenyl)hexyl] ester Formula: C48H70O6 MolecularWeight: 743.0658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCCCCOC(=O)C2=CC(=CC=C2)C(=O)OCCCCCCC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCCCCOC(=O)C2=CC(=CC=C2)C(=O)OCCCCCCC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C48H70O6/c1-45(2,3)37-28-33(29-38(41(37)49)46(4,5)6)22-17-13-15-19-26-53-43(51)35-24-21-25-36(32-35)44(52)54-27-20-16-14-18-23-34-30-39(47(7,8)9)42(50)40(31-34)48(10,11)12/h21,24-25,28-32,49-50H,13-20,22-23,26-27H2,1-12H3