bromanylmethane; [(E)-3-oxidanyl-2-phenyl-prop-2-enyl] 2-fluoranyl-2,2-diphenyl-ethanoate

Systemtic Name: bromanylmethane; [(E)-3-oxidanyl-2-phenyl-prop-2-enyl] 2-fluoranyl-2,2-diphenyl-ethanoate Openeye Name: bromomethane; [(E)-3-hydroxy-2-phenyl-allyl] 2-fluoro-2,2-diphenyl-acetate CAS Name: bromomethane; 2-fluoro-2,2-diphenylacetic acid [(E)-3-hydroxy-2-phenylprop-2-enyl] ester IUPAC Name: bromomethane; [(E)-3-hydroxy-2-phenylprop-2-enyl] 2-fluoro-2,2-diphenylacetate Traditional Name: bromomethane; 2-fluoro-2,2-diphenyl-acetic acid [(E)-3-hydroxy-2-phenyl-allyl] ester Formula: C24H22BrFO3 MolecularWeight: 457.332083

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Descriptors Computed from Structure

Canonical SMILES:

CBr.C1=CC=C(C=C1)C(=CO)COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)F

Isomeric SMILES

CBr.C1=CC=C(C=C1)/C(=C\O)/COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)F

InChI

InChI=1S/C23H19FO3.CH3Br/c24-23(20-12-6-2-7-13-20,21-14-8-3-9-15-21)22(26)27-17-19(16-25)18-10-4-1-5-11-18;1-2/h1-16,25H,17H2;1H3/b19-16-;