methyl 3-[[(5-bromanyl-2-fluoranyl-phenyl)amino]methyl]furan-2-carboxylate

Systemtic Name: methyl 3-[[(5-bromanyl-2-fluoranyl-phenyl)amino]methyl]furan-2-carboxylate Openeye Name: methyl 3-[(5-bromo-2-fluoro-anilino)methyl]furan-2-carboxylate CAS Name: 3-[(5-bromo-2-fluoroanilino)methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-[(5-bromo-2-fluoroanilino)methyl]furan-2-carboxylate Traditional Name: 3-[(5-bromo-2-fluoro-anilino)methyl]furan-2-carboxylic acid methyl ester Formula: C13H11BrFNO3 MolecularWeight: 328.133743

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CO1)CNC2=C(C=CC(=C2)Br)F

Isomeric SMILES

COC(=O)C1=C(C=CO1)CNC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C13H11BrFNO3/c1-18-13(17)12-8(4-5-19-12)7-16-11-6-9(14)2-3-10(11)15/h2-6,16H,7H2,1H3