[(2E)-2-(fluoranylmethylidene)-4,5-bis(oxidanyl)pentyl] benzoate

Systemtic Name: [(2E)-2-(fluoranylmethylidene)-4,5-bis(oxidanyl)pentyl] benzoate Openeye Name: [(2E)-2-(fluoromethylene)-4,5-dihydroxy-pentyl] benzoate CAS Name: benzoic acid [(2E)-2-(fluoromethylidene)-4,5-dihydroxypentyl] ester IUPAC Name: [(2E)-2-(fluoromethylidene)-4,5-dihydroxypentyl] benzoate Traditional Name: benzoic acid [(E)-3-fluoro-2-glyceryl-allyl] ester Formula: C13H15FO4 MolecularWeight: 254.254203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC(=CF)CC(CO)O

Isomeric SMILES

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

InChI

InChI=1S/C13H15FO4/c14-7-10(6-12(16)8-15)9-18-13(17)11-4-2-1-3-5-11/h1-5,7,12,15-16H,6,8-9H2/b10-7+