[2,5-bis[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]cyclopentyl] benzoate

Systemtic Name: [2,5-bis[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]cyclopentyl] benzoate Openeye Name: [2,5-bis[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]cyclopentyl] benzoate CAS Name: benzoic acid [2,5-bis[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]cyclopentyl] ester IUPAC Name: [2,5-bis[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]cyclopentyl] benzoate Traditional Name: benzoic acid [2,5-bis(3,5-ditert-butyl-4-hydroxy-benzyl)cyclopentyl] ester Formula: C42H58O4 MolecularWeight: 626.90752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC2CCC(C2OC(=O)C3=CC=CC=C3)CC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC2CCC(C2OC(=O)C3=CC=CC=C3)CC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C42H58O4/c1-39(2,3)31-22-26(23-32(35(31)43)40(4,5)6)20-29-18-19-30(37(29)46-38(45)28-16-14-13-15-17-28)21-27-24-33(41(7,8)9)36(44)34(25-27)42(10,11)12/h13-17,22-25,29-30,37,43-44H,18-21H2,1-12H3