3-[1,5-bis(4-tert-butylphenyl)-1,5-bis(oxidanylidene)pentan-3-yl]benzoic acid

Systemtic Name: 3-[1,5-bis(4-tert-butylphenyl)-1,5-bis(oxidanylidene)pentan-3-yl]benzoic acid Openeye Name: 3-[3-(4-tert-butylphenyl)-1-[2-(4-tert-butylphenyl)-2-oxo-ethyl]-3-oxo-propyl]benzoic acid CAS Name: 3-[1,5-bis(4-tert-butylphenyl)-1,5-dioxopentan-3-yl]benzoic acid IUPAC Name: 3-[1,5-bis(4-tert-butylphenyl)-1,5-dioxopentan-3-yl]benzoic acid Traditional Name: 3-[3-(4-tert-butylphenyl)-1-[2-(4-tert-butylphenyl)-2-keto-ethyl]-3-keto-propyl]benzoic acid Formula: C32H36O4 MolecularWeight: 484.62584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CC(CC(=O)C2=CC=C(C=C2)C(C)(C)C)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CC(CC(=O)C2=CC=C(C=C2)C(C)(C)C)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C32H36O4/c1-31(2,3)26-14-10-21(11-15-26)28(33)19-25(23-8-7-9-24(18-23)30(35)36)20-29(34)22-12-16-27(17-13-22)32(4,5)6/h7-18,25H,19-20H2,1-6H3,(H,35,36)