1-(bromomethyl)-6-methoxy-7-(trifluoromethyl)-3,4-dihydro-1H-isochromene

Systemtic Name: 1-(bromomethyl)-6-methoxy-7-(trifluoromethyl)-3,4-dihydro-1H-isochromene Openeye Name: 1-(bromomethyl)-6-methoxy-7-(trifluoromethyl)isochromane CAS Name: 1-(bromomethyl)-6-methoxy-7-(trifluoromethyl)-3,4-dihydro-1H-2-benzopyran IUPAC Name: 1-(bromomethyl)-6-methoxy-7-(trifluoromethyl)-3,4-dihydro-1H-isochromene Traditional Name: 1-(bromomethyl)-6-methoxy-7-(trifluoromethyl)isochroman Formula: C12H12BrF3O2 MolecularWeight: 325.12169

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(OCCC2=C1)CBr)C(F)(F)F

Isomeric SMILES

COC1=C(C=C2C(OCCC2=C1)CBr)C(F)(F)F

InChI

InChI=1S/C12H12BrF3O2/c1-17-10-4-7-2-3-18-11(6-13)8(7)5-9(10)12(14,15)16/h4-5,11H,2-3,6H2,1H3