2,5-bis[(4-butan-2-ylphenyl)carbonyl]terephthalic acid

Systemtic Name: 2,5-bis[(4-butan-2-ylphenyl)carbonyl]terephthalic acid Openeye Name: 2,5-bis(4-sec-butylbenzoyl)terephthalic acid CAS Name: 2,5-bis[(4-butan-2-ylphenyl)-oxomethyl]terephthalic acid IUPAC Name: 2,5-bis(4-butan-2-ylbenzoyl)terephthalic acid Traditional Name: 2,5-bis(4-sec-butylbenzoyl)terephthalic acid Formula: C30H30O6 MolecularWeight: 486.5556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2C(=O)O)C(=O)C3=CC=C(C=C3)C(C)CC)C(=O)O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2C(=O)O)C(=O)C3=CC=C(C=C3)C(C)CC)C(=O)O

InChI

InChI=1S/C30H30O6/c1-5-17(3)19-7-11-21(12-8-19)27(31)23-15-26(30(35)36)24(16-25(23)29(33)34)28(32)22-13-9-20(10-14-22)18(4)6-2/h7-18H,5-6H2,1-4H3,(H,33,34)(H,35,36)