methyl 2-[[3-bromanyl-1-[(3-fluorophenyl)methyl]-2-oxidanylidene-pyridin-4-yl]oxymethyl]benzoate

Systemtic Name: methyl 2-[[3-bromanyl-1-[(3-fluorophenyl)methyl]-2-oxidanylidene-pyridin-4-yl]oxymethyl]benzoate Openeye Name: methyl 2-[[3-bromo-1-[(3-fluorophenyl)methyl]-2-oxo-4-pyridyl]oxymethyl]benzoate CAS Name: 2-[[3-bromo-1-[(3-fluorophenyl)methyl]-2-oxo-4-pyridinyl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[3-bromo-1-[(3-fluorophenyl)methyl]-2-oxopyridin-4-yl]oxymethyl]benzoate Traditional Name: 2-[[3-bromo-1-(3-fluorobenzyl)-2-keto-4-pyridyl]oxymethyl]benzoic acid methyl ester Formula: C21H17BrFNO4 MolecularWeight: 446.266383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1COC2=C(C(=O)N(C=C2)CC3=CC(=CC=C3)F)Br

Isomeric SMILES

COC(=O)C1=CC=CC=C1COC2=C(C(=O)N(C=C2)CC3=CC(=CC=C3)F)Br

InChI

InChI=1S/C21H17BrFNO4/c1-27-21(26)17-8-3-2-6-15(17)13-28-18-9-10-24(20(25)19(18)22)12-14-5-4-7-16(23)11-14/h2-11H,12-13H2,1H3