methyl 4-[(E)-2-fluoranyl-3-oxidanylidene-but-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-2-fluoranyl-3-oxidanylidene-but-1-enyl]benzoate Openeye Name: methyl 4-[(E)-2-fluoro-3-oxo-but-1-enyl]benzoate CAS Name: 4-[(E)-2-fluoro-3-oxobut-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-fluoro-3-oxobut-1-enyl]benzoate Traditional Name: 4-[(E)-2-fluoro-3-keto-but-1-enyl]benzoic acid methyl ester Formula: C12H11FO3 MolecularWeight: 222.212343

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=C(C=C1)C(=O)OC)F

Isomeric SMILES

CC(=O)/C(=C\C1=CC=C(C=C1)C(=O)OC)/F

InChI

InChI=1S/C12H11FO3/c1-8(14)11(13)7-9-3-5-10(6-4-9)12(15)16-2/h3-7H,1-2H3/b11-7+