[1-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]amino]propan-2-yl] 3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]amino]propan-2-yl] 3-methyl-1-benzofuran-2-carboxylate Openeye Name: [1-methyl-2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 3-methylbenzofuran-2-carboxylate CAS Name: 3-methyl-2-benzofurancarboxylic acid [1-oxo-1-[3-(trifluoromethyl)anilino]propan-2-yl] ester IUPAC Name: [1-oxo-1-[3-(trifluoromethyl)anilino]propan-2-yl] 3-methyl-1-benzofuran-2-carboxylate Traditional Name: 3-methylcoumarilic acid [2-keto-1-methyl-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C20H16F3NO4 MolecularWeight: 391.34055

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)OC(C)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)OC(C)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H16F3NO4/c1-11-15-8-3-4-9-16(15)28-17(11)19(26)27-12(2)18(25)24-14-7-5-6-13(10-14)20(21,22)23/h3-10,12H,1-2H3,(H,24,25)