[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 5-bromanylpyridine-3-carboxylate

Systemtic Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 5-bromanylpyridine-3-carboxylate Openeye Name: [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [5-(4-fluorophenyl)-4-methyl-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl ester Formula: C17H12BrFN2O3 MolecularWeight: 391.191183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1COC(=O)C2=CC(=CN=C2)Br)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(ON=C1COC(=O)C2=CC(=CN=C2)Br)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H12BrFN2O3/c1-10-15(9-23-17(22)12-6-13(18)8-20-7-12)21-24-16(10)11-2-4-14(19)5-3-11/h2-8H,9H2,1H3