(3S)-3-(3-oxidanylidene-1H-isoindol-2-yl)-3-[3-(trifluoromethyl)phenyl]propanoate

Systemtic Name: (3S)-3-(3-oxidanylidene-1H-isoindol-2-yl)-3-[3-(trifluoromethyl)phenyl]propanoate Openeye Name: (3S)-3-(1-oxoisoindolin-2-yl)-3-[3-(trifluoromethyl)phenyl]propanoate CAS Name: (3S)-3-(3-oxo-1H-isoindol-2-yl)-3-[3-(trifluoromethyl)phenyl]propanoate IUPAC Name: (3S)-3-(3-oxo-1H-isoindol-2-yl)-3-[3-(trifluoromethyl)phenyl]propanoate Traditional Name: (3S)-3-(1-ketoisoindolin-2-yl)-3-[3-(trifluoromethyl)phenyl]propionate Formula: C18H13F3NO3- MolecularWeight: 348.29593

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N1C(CC(=O)[O-])C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N1[C@@H](CC(=O)[O-])C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3NO3/c19-18(20,21)13-6-3-5-11(8-13)15(9-16(23)24)22-10-12-4-1-2-7-14(12)17(22)25/h1-8,15H,9-10H2,(H,23,24)/p-1/t15-/m0/s1