[2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 3-bromanyl-4-ethoxy-5-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 3-bromanyl-4-ethoxy-5-methoxy-benzoate Openeye Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 3-bromo-4-ethoxy-5-methoxy-benzoate CAS Name: 3-bromo-4-ethoxy-5-methoxybenzoic acid [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 3-bromo-4-ethoxy-5-methoxybenzoate Traditional Name: 3-bromo-4-ethoxy-5-methoxy-benzoic acid [2-keto-2-(2,2,2-trifluoroethylamino)ethyl] ester Formula: C14H15BrF3NO5 MolecularWeight: 414.17181

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)NCC(F)(F)F)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)NCC(F)(F)F)OC

InChI

InChI=1S/C14H15BrF3NO5/c1-3-23-12-9(15)4-8(5-10(12)22-2)13(21)24-6-11(20)19-7-14(16,17)18/h4-5H,3,6-7H2,1-2H3,(H,19,20)