methyl 5-iodanyl-2-oxidanylidene-1-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxylate

Systemtic Name: methyl 5-iodanyl-2-oxidanylidene-1-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxylate Openeye Name: methyl 5-iodo-2-oxo-1-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxylate CAS Name: 5-iodo-2-oxo-1-[[4-(trifluoromethyl)phenyl]methyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-iodo-2-oxo-1-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxylate Traditional Name: 5-iodo-2-keto-1-[4-(trifluoromethyl)benzyl]nicotinic acid methyl ester Formula: C15H11F3INO3 MolecularWeight: 437.15242

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN(C1=O)CC2=CC=C(C=C2)C(F)(F)F)I

Isomeric SMILES

COC(=O)C1=CC(=CN(C1=O)CC2=CC=C(C=C2)C(F)(F)F)I

InChI

InChI=1S/C15H11F3INO3/c1-23-14(22)12-6-11(19)8-20(13(12)21)7-9-2-4-10(5-3-9)15(16,17)18/h2-6,8H,7H2,1H3