ethyl 4-(3-bromanyl-4-fluoranyl-phenyl)-5-oxidanylidene-2-propan-2-yl-4,8-dihydro-1H-pyrano[3,4-b]pyridine-3-carboxylate

Systemtic Name: ethyl 4-(3-bromanyl-4-fluoranyl-phenyl)-5-oxidanylidene-2-propan-2-yl-4,8-dihydro-1H-pyrano[3,4-b]pyridine-3-carboxylate Openeye Name: ethyl 4-(3-bromo-4-fluoro-phenyl)-2-isopropyl-5-oxo-4,8-dihydro-1H-pyrano[3,4-b]pyridine-3-carboxylate CAS Name: 4-(3-bromo-4-fluorophenyl)-5-oxo-2-propan-2-yl-4,8-dihydro-1H-pyrano[3,4-b]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-bromo-4-fluorophenyl)-5-oxo-2-propan-2-yl-4,8-dihydro-1H-pyrano[3,4-b]pyridine-3-carboxylate Traditional Name: 4-(3-bromo-4-fluoro-phenyl)-2-isopropyl-5-keto-4,8-dihydro-1H-pyrano[3,4-b]pyridine-3-carboxylic acid ethyl ester Formula: C20H21BrFNO4 MolecularWeight: 438.287443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)F)Br)C(=O)COC2)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)F)Br)C(=O)COC2)C(C)C

InChI

InChI=1S/C20H21BrFNO4/c1-4-27-20(25)18-16(11-5-6-13(22)12(21)7-11)17-14(8-26-9-15(17)24)23-19(18)10(2)3/h5-7,10,16,23H,4,8-9H2,1-3H3