ethyl 2,6-bis[bis(fluoranyl)methyl]-1-ethyl-4-(2-methylpropyl)-5-oxaldehydoyl-4H-pyridine-3-carboxylate

Systemtic Name: ethyl 2,6-bis[bis(fluoranyl)methyl]-1-ethyl-4-(2-methylpropyl)-5-oxaldehydoyl-4H-pyridine-3-carboxylate Openeye Name: ethyl 2,6-bis(difluoromethyl)-1-ethyl-4-isobutyl-5-oxaldehydoyl-4H-pyridine-3-carboxylate CAS Name: 2,6-bis(difluoromethyl)-1-ethyl-4-(2-methylpropyl)-5-oxaldehydoyl-4H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,6-bis(difluoromethyl)-1-ethyl-4-(2-methylpropyl)-5-oxaldehydoyl-4H-pyridine-3-carboxylate Traditional Name: 2,6-bis(difluoromethyl)-1-ethyl-5-glyoxyloyl-4-isobutyl-4H-pyridine-3-carboxylic acid ethyl ester Formula: C18H23F4NO4 MolecularWeight: 393.373133

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(C(=C1C(F)F)C(=O)OCC)CC(C)C)C(=O)C=O)C(F)F

Isomeric SMILES

CCN1C(=C(C(C(=C1C(F)F)C(=O)OCC)CC(C)C)C(=O)C=O)C(F)F

InChI

InChI=1S/C18H23F4NO4/c1-5-23-14(16(19)20)12(11(25)8-24)10(7-9(3)4)13(15(23)17(21)22)18(26)27-6-2/h8-10,16-17H,5-7H2,1-4H3