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2,4-diphenylbenzene-1,3-dicarboxylic acid; terephthalic acid

2,4-diphenylbenzene-1,3-dicarboxylic acid; terephthalic acid

Systemtic Name:2,4-diphenylbenzene-1,3-dicarboxylic acid; terephthalic acid
Openeye Name:2,4-diphenylbenzene-1,3-dicarboxylic acid; terephthalic acid
CAS Name:2,4-diphenylbenzene-1,3-dicarboxylic acid; terephthalic acid
IUPAC Name:2,4-diphenylbenzene-1,3-dicarboxylic acid; terephthalic acid
Traditional Name:2,4-diphenylisophthalic acid; terephthalic acid
Formula: C28H20O8
MolecularWeight: 484.4536
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)O)C3=CC=CC=C3)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)O)C3=CC=CC=C3)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O


InChI

InChI=1S/C20H14O4.C8H6O4/c21-19(22)16-12-11-15(13-7-3-1-4-8-13)18(20(23)24)17(16)14-9-5-2-6-10-14;9-7(10)5-1-2-6(4-3-5)8(11)12/h1-12H,(H,21,22)(H,23,24);1-4H,(H,9,10)(H,11,12)


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