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

Systemtic Name: [(2E)-4-bromanyl-2-(fluoranylmethylidene)butyl] benzoate Openeye Name: [(2E)-4-bromo-2-(fluoromethylene)butyl] benzoate CAS Name: benzoic acid [(2E)-4-bromo-2-(fluoromethylidene)butyl] ester IUPAC Name: [(2E)-4-bromo-2-(fluoromethylidene)butyl] benzoate Traditional Name: benzoic acid [(E)-2-(2-bromoethyl)-3-fluoro-allyl] ester Formula: C12H12BrFO2 MolecularWeight: 287.124883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12BrFO2/c13-7-6-10(8-14)9-16-12(15)11-4-2-1-3-5-11/h1-5,8H,6-7,9H2/b10-8+