[2-[2,5-dimethyl-1-[2,2,2-tris(fluoranyl)ethyl]pyrrol-3-yl]-2-oxidanylidene-ethyl] 2-(6-methoxy-1-benzofuran-3-yl)ethanoate

Systemtic Name: [2-[2,5-dimethyl-1-[2,2,2-tris(fluoranyl)ethyl]pyrrol-3-yl]-2-oxidanylidene-ethyl] 2-(6-methoxy-1-benzofuran-3-yl)ethanoate Openeye Name: [2-[2,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrrol-3-yl]-2-oxo-ethyl] 2-(6-methoxybenzofuran-3-yl)acetate CAS Name: 2-(6-methoxy-3-benzofuranyl)acetic acid [2-[2,5-dimethyl-1-(2,2,2-trifluoroethyl)-3-pyrrolyl]-2-oxoethyl] ester IUPAC Name: [2-[2,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrrol-3-yl]-2-oxoethyl] 2-(6-methoxy-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-methoxybenzofuran-3-yl)acetic acid [2-[2,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrrol-3-yl]-2-keto-ethyl] ester Formula: C21H20F3NO5 MolecularWeight: 423.38241

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC(F)(F)F)C)C(=O)COC(=O)CC2=COC3=C2C=CC(=C3)OC

Isomeric SMILES

CC1=CC(=C(N1CC(F)(F)F)C)C(=O)COC(=O)CC2=COC3=C2C=CC(=C3)OC

InChI

InChI=1S/C21H20F3NO5/c1-12-6-17(13(2)25(12)11-21(22,23)24)18(26)10-30-20(27)7-14-9-29-19-8-15(28-3)4-5-16(14)19/h4-6,8-9H,7,10-11H2,1-3H3