[2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 2-bromanyl-5-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 2-bromanyl-5-methoxy-benzoate Openeye Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid [2-keto-2-(2,2,2-trifluoroethylamino)ethyl] ester Formula: C12H11BrF3NO4 MolecularWeight: 370.11925

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)OCC(=O)NCC(F)(F)F

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)OCC(=O)NCC(F)(F)F

InChI

InChI=1S/C12H11BrF3NO4/c1-20-7-2-3-9(13)8(4-7)11(19)21-5-10(18)17-6-12(14,15)16/h2-4H,5-6H2,1H3,(H,17,18)