3-(3-oxidanylidene-1H-isoindol-2-yl)-3-[4-(trifluoromethyl)phenyl]propanoic acid

Systemtic Name: 3-(3-oxidanylidene-1H-isoindol-2-yl)-3-[4-(trifluoromethyl)phenyl]propanoic acid Openeye Name: 3-(1-oxoisoindolin-2-yl)-3-[4-(trifluoromethyl)phenyl]propanoic acid CAS Name: 3-(3-oxo-1H-isoindol-2-yl)-3-[4-(trifluoromethyl)phenyl]propanoic acid IUPAC Name: 3-(3-oxo-1H-isoindol-2-yl)-3-[4-(trifluoromethyl)phenyl]propanoic acid Traditional Name: 3-(1-ketoisoindolin-2-yl)-3-[4-(trifluoromethyl)phenyl]propionic acid Formula: C18H14F3NO3 MolecularWeight: 349.30387

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3NO3/c19-18(20,21)13-7-5-11(6-8-13)15(9-16(23)24)22-10-12-3-1-2-4-14(12)17(22)25/h1-8,15H,9-10H2,(H,23,24)