(phenylmethyl) 2-[[2-fluoranyl-4-(trifluoromethyl)phenyl]amino]-3-methyl-butanoate

Systemtic Name: (phenylmethyl) 2-[[2-fluoranyl-4-(trifluoromethyl)phenyl]amino]-3-methyl-butanoate Openeye Name: benzyl 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methyl-butanoate CAS Name: 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methylbutanoate Traditional Name: 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methyl-butyric acid benzyl ester Formula: C19H19F4NO2 MolecularWeight: 369.353273

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=CC=C1)NC2=C(C=C(C=C2)C(F)(F)F)F

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC=CC=C1)NC2=C(C=C(C=C2)C(F)(F)F)F

InChI

InChI=1S/C19H19F4NO2/c1-12(2)17(18(25)26-11-13-6-4-3-5-7-13)24-16-9-8-14(10-15(16)20)19(21,22)23/h3-10,12,17,24H,11H2,1-2H3