4-(2,5-dimethylphenyl)carbonyl-6-(2-methylphenyl)carbonyl-benzene-1,3-dicarboxylic acid

Systemtic Name: 4-(2,5-dimethylphenyl)carbonyl-6-(2-methylphenyl)carbonyl-benzene-1,3-dicarboxylic acid Openeye Name: 4-(2,5-dimethylbenzoyl)-6-(2-methylbenzoyl)benzene-1,3-dicarboxylic acid CAS Name: 4-[(2,5-dimethylphenyl)-oxomethyl]-6-[(2-methylphenyl)-oxomethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-(2,5-dimethylbenzoyl)-6-(2-methylbenzoyl)benzene-1,3-dicarboxylic acid Traditional Name: 4-(2,5-dimethylbenzoyl)-6-o-toluoyl-isophthalic acid Formula: C25H20O6 MolecularWeight: 416.4227

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C2=C(C=C(C(=C2)C(=O)C3=CC=CC=C3C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)C2=C(C=C(C(=C2)C(=O)C3=CC=CC=C3C)C(=O)O)C(=O)O

InChI

InChI=1S/C25H20O6/c1-13-8-9-15(3)17(10-13)23(27)19-11-18(20(24(28)29)12-21(19)25(30)31)22(26)16-7-5-4-6-14(16)2/h4-12H,1-3H3,(H,28,29)(H,30,31)