methyl 5-[(4-chloranyl-2-fluoranyl-5-prop-2-ynoxy-phenyl)amino]-5-oxidanylidene-3-(trifluoromethyl)pentanoate

Systemtic Name: methyl 5-[(4-chloranyl-2-fluoranyl-5-prop-2-ynoxy-phenyl)amino]-5-oxidanylidene-3-(trifluoromethyl)pentanoate Openeye Name: methyl 5-(4-chloro-2-fluoro-5-prop-2-ynoxy-anilino)-5-oxo-3-(trifluoromethyl)pentanoate CAS Name: 5-(4-chloro-2-fluoro-5-prop-2-ynoxyanilino)-5-oxo-3-(trifluoromethyl)pentanoic acid methyl ester IUPAC Name: methyl 5-(4-chloro-2-fluoro-5-prop-2-ynoxyanilino)-5-oxo-3-(trifluoromethyl)pentanoate Traditional Name: 5-(4-chloro-2-fluoro-5-propargyloxy-anilino)-5-keto-3-(trifluoromethyl)valeric acid methyl ester Formula: C16H14ClF4NO4 MolecularWeight: 395.733273

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(=O)NC1=CC(=C(C=C1F)Cl)OCC#C)C(F)(F)F

Isomeric SMILES

COC(=O)CC(CC(=O)NC1=CC(=C(C=C1F)Cl)OCC#C)C(F)(F)F

InChI

InChI=1S/C16H14ClF4NO4/c1-3-4-26-13-8-12(11(18)7-10(13)17)22-14(23)5-9(16(19,20)21)6-15(24)25-2/h1,7-9H,4-6H2,2H3,(H,22,23)