methyl 3-bromanyl-4-[2-[2-cyanoethyl-(2-fluorophenyl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-bromanyl-4-[2-[2-cyanoethyl-(2-fluorophenyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-bromo-4-[2-[N-(2-cyanoethyl)-2-fluoro-anilino]-2-oxo-ethoxy]benzoate CAS Name: 3-bromo-4-[2-[N-(2-cyanoethyl)-2-fluoroanilino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-[2-[N-(2-cyanoethyl)-2-fluoroanilino]-2-oxoethoxy]benzoate Traditional Name: 3-bromo-4-[2-[N-(2-cyanoethyl)-2-fluoro-anilino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C19H16BrFN2O4 MolecularWeight: 435.243743

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC(=O)N(CCC#N)C2=CC=CC=C2F)Br

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC(=O)N(CCC#N)C2=CC=CC=C2F)Br

InChI

InChI=1S/C19H16BrFN2O4/c1-26-19(25)13-7-8-17(14(20)11-13)27-12-18(24)23(10-4-9-22)16-6-3-2-5-15(16)21/h2-3,5-8,11H,4,10,12H2,1H3