2-(4-dodecylphenyl)carbonyl-5-(4-methylphenyl)carbonyl-terephthalic acid

Systemtic Name: 2-(4-dodecylphenyl)carbonyl-5-(4-methylphenyl)carbonyl-terephthalic acid Openeye Name: 2-(4-dodecylbenzoyl)-5-(4-methylbenzoyl)terephthalic acid CAS Name: 2-[(4-dodecylphenyl)-oxomethyl]-5-[(4-methylphenyl)-oxomethyl]terephthalic acid IUPAC Name: 2-(4-dodecylbenzoyl)-5-(4-methylbenzoyl)terephthalic acid Traditional Name: 2-(4-laurylbenzoyl)-5-p-toluoyl-terephthalic acid Formula: C35H40O6 MolecularWeight: 556.6885

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C2=C(C=C(C(=C2)C(=O)O)C(=O)C3=CC=C(C=C3)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C2=C(C=C(C(=C2)C(=O)O)C(=O)C3=CC=C(C=C3)C)C(=O)O

InChI

InChI=1S/C35H40O6/c1-3-4-5-6-7-8-9-10-11-12-13-25-16-20-27(21-17-25)33(37)29-23-30(34(38)39)28(22-31(29)35(40)41)32(36)26-18-14-24(2)15-19-26/h14-23H,3-13H2,1-2H3,(H,38,39)(H,40,41)