diethyl 4-(3-bromanyl-4-fluoranyl-phenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-(3-bromanyl-4-fluoranyl-phenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(3-bromo-4-fluoro-phenyl)-1-(tetrahydrofuran-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-bromo-4-fluorophenyl)-1-(2-oxolanylmethyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(3-bromo-4-fluorophenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-bromo-4-fluoro-phenyl)-1-(tetrahydrofurfuryl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C22H25BrFNO5 MolecularWeight: 482.340003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C=C(C1C2=CC(=C(C=C2)F)Br)C(=O)OCC)CC3CCCO3

Isomeric SMILES

CCOC(=O)C1=CN(C=C(C1C2=CC(=C(C=C2)F)Br)C(=O)OCC)CC3CCCO3

InChI

InChI=1S/C22H25BrFNO5/c1-3-28-21(26)16-12-25(11-15-6-5-9-30-15)13-17(22(27)29-4-2)20(16)14-7-8-19(24)18(23)10-14/h7-8,10,12-13,15,20H,3-6,9,11H2,1-2H3