(6-bromanyl-1,3-benzodioxol-5-yl)methyl 3-(trifluoromethyl)benzoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 3-(trifluoromethyl)benzoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C16H10BrF3O4 MolecularWeight: 403.14741

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=CC(=CC=C3)C(F)(F)F)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=CC(=CC=C3)C(F)(F)F)Br

InChI

InChI=1S/C16H10BrF3O4/c17-12-6-14-13(23-8-24-14)5-10(12)7-22-15(21)9-2-1-3-11(4-9)16(18,19)20/h1-6H,7-8H2