2-[3-oxidanylidene-5-(trifluoromethyl)-1,2-dihydroisoindol-1-yl]ethanoic acid

Systemtic Name: 2-[3-oxidanylidene-5-(trifluoromethyl)-1,2-dihydroisoindol-1-yl]ethanoic acid Openeye Name: 2-[3-oxo-5-(trifluoromethyl)isoindolin-1-yl]acetic acid CAS Name: 2-[3-oxo-5-(trifluoromethyl)-1,2-dihydroisoindol-1-yl]acetic acid IUPAC Name: 2-[3-oxo-5-(trifluoromethyl)-1,2-dihydroisoindol-1-yl]acetic acid Traditional Name: 2-[3-keto-5-(trifluoromethyl)isoindolin-1-yl]acetic acid Formula: C11H8F3NO3 MolecularWeight: 259.18133

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)C(=O)NC2CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)C(=O)NC2CC(=O)O

InChI

InChI=1S/C11H8F3NO3/c12-11(13,14)5-1-2-6-7(3-5)10(18)15-8(6)4-9(16)17/h1-3,8H,4H2,(H,15,18)(H,16,17)