trideuteriomethyl 4-bromanyl-2-(trideuteriomethoxy)benzoate

Systemtic Name: trideuteriomethyl 4-bromanyl-2-(trideuteriomethoxy)benzoate Openeye Name: trideuteriomethyl 4-bromo-2-(trideuteriomethoxy)benzoate CAS Name: 4-bromo-2-(trideuteriomethoxy)benzoic acid trideuteriomethyl ester IUPAC Name: trideuteriomethyl 4-bromo-2-(trideuteriomethoxy)benzoate Traditional Name: 4-bromo-2-(trideuteriomethoxy)benzoic acid trideuteriomethyl ester Formula: C9H9BrO3 MolecularWeight: 251.106931

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)Br)C(=O)OC

Isomeric SMILES

[2H]C([2H])([2H])OC1=C(C=CC(=C1)Br)C(=O)OC([2H])([2H])[2H]

InChI

InChI=1S/C9H9BrO3/c1-12-8-5-6(10)3-4-7(8)9(11)13-2/h3-5H,1-2H3/i1D3,2D3