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

Systemtic Name: 2-[[2-fluoranyl-4-(trifluoromethyl)phenyl]amino]-3-methyl-butanoate Openeye Name: 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methyl-butanoate CAS Name: 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methylbutanoate IUPAC Name: 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methylbutanoate Traditional Name: 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methyl-butyrate Formula: C12H12F4NO2- MolecularWeight: 278.222793

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC1=C(C=C(C=C1)C(F)(F)F)F

Isomeric SMILES

CC(C)C(C(=O)[O-])NC1=C(C=C(C=C1)C(F)(F)F)F

InChI

InChI=1S/C12H13F4NO2/c1-6(2)10(11(18)19)17-9-4-3-7(5-8(9)13)12(14,15)16/h3-6,10,17H,1-2H3,(H,18,19)/p-1