[(2E)-2-(fluoranylmethylidene)-4-oxidanyl-butyl] benzoate

Systemtic Name: [(2E)-2-(fluoranylmethylidene)-4-oxidanyl-butyl] benzoate Openeye Name: [(2E)-2-(fluoromethylene)-4-hydroxy-butyl] benzoate CAS Name: benzoic acid [(2E)-2-(fluoromethylidene)-4-hydroxybutyl] ester IUPAC Name: [(2E)-2-(fluoromethylidene)-4-hydroxybutyl] benzoate Traditional Name: benzoic acid [(E)-3-fluoro-2-(2-hydroxyethyl)allyl] ester Formula: C12H13FO3 MolecularWeight: 224.228223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13FO3/c13-8-10(6-7-14)9-16-12(15)11-4-2-1-3-5-11/h1-5,8,14H,6-7,9H2/b10-8+