4,6-bis[(4-ethylphenyl)carbonyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 4,6-bis[(4-ethylphenyl)carbonyl]benzene-1,3-dicarboxylic acid Openeye Name: 4,6-bis(4-ethylbenzoyl)benzene-1,3-dicarboxylic acid CAS Name: 4,6-bis[(4-ethylphenyl)-oxomethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4,6-bis(4-ethylbenzoyl)benzene-1,3-dicarboxylic acid Traditional Name: 4,6-bis(4-ethylbenzoyl)isophthalic acid Formula: C26H22O6 MolecularWeight: 430.44928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2C(=O)O)C(=O)O)C(=O)C3=CC=C(C=C3)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2C(=O)O)C(=O)O)C(=O)C3=CC=C(C=C3)CC

InChI

InChI=1S/C26H22O6/c1-3-15-5-9-17(10-6-15)23(27)19-13-20(22(26(31)32)14-21(19)25(29)30)24(28)18-11-7-16(4-2)8-12-18/h5-14H,3-4H2,1-2H3,(H,29,30)(H,31,32)