2-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]carbonylamino]terephthalic acid Openeye Name: 2-[[5-[3-(trifluoromethyl)phenyl]furan-2-carbonyl]amino]terephthalic acid CAS Name: 2-[[oxo-[5-[3-(trifluoromethyl)phenyl]-2-furanyl]methyl]amino]terephthalic acid IUPAC Name: 2-[[5-[3-(trifluoromethyl)phenyl]furan-2-carbonyl]amino]terephthalic acid Traditional Name: 2-[[5-[3-(trifluoromethyl)phenyl]-2-furoyl]amino]terephthalic acid Formula: C20H12F3NO6 MolecularWeight: 419.30759

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C2=CC=C(O2)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C2=CC=C(O2)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C20H12F3NO6/c21-20(22,23)12-3-1-2-10(8-12)15-6-7-16(30-15)17(25)24-14-9-11(18(26)27)4-5-13(14)19(28)29/h1-9H,(H,24,25)(H,26,27)(H,28,29)