methyl 5-[[4-[[3-chloranyl-2-fluoranyl-6-(trifluoromethyl)phenyl]carbonylamino]pyrazol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[[3-chloranyl-2-fluoranyl-6-(trifluoromethyl)phenyl]carbonylamino]pyrazol-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-[[3-chloro-2-fluoro-6-(trifluoromethyl)benzoyl]amino]pyrazol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[4-[[[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-oxomethyl]amino]-1-pyrazolyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[[3-chloro-2-fluoro-6-(trifluoromethyl)benzoyl]amino]pyrazol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[4-[[3-chloro-2-fluoro-6-(trifluoromethyl)benzoyl]amino]pyrazol-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C18H12ClF4N3O4 MolecularWeight: 445.752193

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CN2C=C(C=N2)NC(=O)C3=C(C=CC(=C3F)Cl)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(O1)CN2C=C(C=N2)NC(=O)C3=C(C=CC(=C3F)Cl)C(F)(F)F

InChI

InChI=1S/C18H12ClF4N3O4/c1-29-17(28)13-5-2-10(30-13)8-26-7-9(6-24-26)25-16(27)14-11(18(21,22)23)3-4-12(19)15(14)20/h2-7H,8H2,1H3,(H,25,27)