methyl 3-[2-methanoyl-4-(trifluoromethylperoxysulfanyloxy)phenyl]-6-(2-methylpropylcarbamoyl)pyridine-2-carboxylate

Systemtic Name: methyl 3-[2-methanoyl-4-(trifluoromethylperoxysulfanyloxy)phenyl]-6-(2-methylpropylcarbamoyl)pyridine-2-carboxylate Openeye Name: methyl 3-[2-formyl-4-(trifluoromethylperoxysulfanyloxy)phenyl]-6-(isobutylcarbamoyl)pyridine-2-carboxylate CAS Name: 3-[2-formyl-4-(trifluoromethyldioxythio)oxyphenyl]-6-[(2-methylpropylamino)-oxomethyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-formyl-4-(trifluoromethylperoxysulfanyloxy)phenyl]-6-(2-methylpropylcarbamoyl)pyridine-2-carboxylate Traditional Name: 3-[2-formyl-4-(trifluoromethylperoxythio)oxy-phenyl]-6-(isobutylcarbamoyl)picolinic acid methyl ester Formula: C20H19F3N2O7S MolecularWeight: 488.43427

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=NC(=C(C=C1)C2=C(C=C(C=C2)OSOOC(F)(F)F)C=O)C(=O)OC

Isomeric SMILES

CC(C)CNC(=O)C1=NC(=C(C=C1)C2=C(C=C(C=C2)OSOOC(F)(F)F)C=O)C(=O)OC

InChI

InChI=1S/C20H19F3N2O7S/c1-11(2)9-24-18(27)16-7-6-15(17(25-16)19(28)29-3)14-5-4-13(8-12(14)10-26)30-33-32-31-20(21,22)23/h4-8,10-11H,9H2,1-3H3,(H,24,27)