2,3-bis[2-tert-butyl-6-[(3-tert-butyl-5-methyl-2-oxidanyl-phenyl)methyl]-4-methyl-phenyl]terephthalic acid; cyclopenta-1,3-diene

Systemtic Name: 2,3-bis[2-tert-butyl-6-[(3-tert-butyl-5-methyl-2-oxidanyl-phenyl)methyl]-4-methyl-phenyl]terephthalic acid; cyclopenta-1,3-diene Openeye Name: 2,3-bis[2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methyl-phenyl)methyl]-4-methyl-phenyl]terephthalic acid; cyclopenta-1,3-diene CAS Name: 2,3-bis[2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenyl]terephthalic acid; cyclopenta-1,3-diene IUPAC Name: 2,3-bis[2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenyl]terephthalic acid; cyclopenta-1,3-diene Traditional Name: 2,3-bis[2-tert-butyl-6-(3-tert-butyl-2-hydroxy-5-methyl-benzyl)-4-methyl-phenyl]terephthalic acid; cyclopenta-1,3-diene Formula: C64H78O6 MolecularWeight: 943.30052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C)(C)C)C2=C(C=CC(=C2C3=C(C=C(C=C3C(C)(C)C)C)CC4=C(C(=CC(=C4)C)C(C)(C)C)O)C(=O)O)C(=O)O)CC5=C(C(=CC(=C5)C)C(C)(C)C)O.C1C=CC=C1.C1C=CC=C1

Isomeric SMILES

CC1=CC(=C(C(=C1)C(C)(C)C)C2=C(C=CC(=C2C3=C(C=C(C=C3C(C)(C)C)C)CC4=C(C(=CC(=C4)C)C(C)(C)C)O)C(=O)O)C(=O)O)CC5=C(C(=CC(=C5)C)C(C)(C)C)O.C1C=CC=C1.C1C=CC=C1

InChI

InChI=1S/C54H66O6.2C5H6/c1-29-19-33(27-35-21-31(3)25-41(47(35)55)53(11,12)13)43(39(23-29)51(5,6)7)45-37(49(57)58)17-18-38(50(59)60)46(45)44-34(20-30(2)24-40(44)52(8,9)10)28-36-22-32(4)26-42(48(36)56)54(14,15)16;2*1-2-4-5-3-1/h17-26,55-56H,27-28H2,1-16H3,(H,57,58)(H,59,60);2*1-4H,5H2