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4-[2-phenyl-6-(trifluoromethyl)phenoxy]phthalic acid

4-[2-phenyl-6-(trifluoromethyl)phenoxy]phthalic acid

Systemtic Name:4-[2-phenyl-6-(trifluoromethyl)phenoxy]phthalic acid
Openeye Name:4-[2-phenyl-6-(trifluoromethyl)phenoxy]phthalic acid
CAS Name:4-[2-phenyl-6-(trifluoromethyl)phenoxy]phthalic acid
IUPAC Name:4-[2-phenyl-6-(trifluoromethyl)phenoxy]phthalic acid
Traditional Name:4-[2-phenyl-6-(trifluoromethyl)phenoxy]phthalic acid
Formula: C21H13F3O5
MolecularWeight: 402.32013
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=CC=C2)C(F)(F)F)OC3=CC(=C(C=C3)C(=O)O)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=CC=C2)C(F)(F)F)OC3=CC(=C(C=C3)C(=O)O)C(=O)O


InChI

InChI=1S/C21H13F3O5/c22-21(23,24)17-8-4-7-14(12-5-2-1-3-6-12)18(17)29-13-9-10-15(19(25)26)16(11-13)20(27)28/h1-11H,(H,25,26)(H,27,28)


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