ethyl 5-[2-fluoranyl-5-[(E)-3-oxidanylprop-1-enyl]phenyl]-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-[2-fluoranyl-5-[(E)-3-oxidanylprop-1-enyl]phenyl]-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-[2-fluoro-5-[(E)-3-hydroxyprop-1-enyl]phenyl]isoxazole-3-carboxylate CAS Name: 5-[2-fluoro-5-[(E)-3-hydroxyprop-1-enyl]phenyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-fluoro-5-[(E)-3-hydroxyprop-1-enyl]phenyl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[2-fluoro-5-[(E)-3-hydroxyprop-1-enyl]phenyl]isoxazole-3-carboxylic acid ethyl ester Formula: C15H14FNO4 MolecularWeight: 291.274363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1)C2=C(C=CC(=C2)C=CCO)F

Isomeric SMILES

CCOC(=O)C1=NOC(=C1)C2=C(C=CC(=C2)/C=C/CO)F

InChI

InChI=1S/C15H14FNO4/c1-2-20-15(19)13-9-14(21-17-13)11-8-10(4-3-7-18)5-6-12(11)16/h3-6,8-9,18H,2,7H2,1H3/b4-3+