5-[(4-bromanyl-2-fluoranyl-phenoxy)methyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[(4-bromanyl-2-fluoranyl-phenoxy)methyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[(4-bromo-2-fluoro-phenoxy)methyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[(4-bromo-2-fluorophenoxy)methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[(4-bromo-2-fluorophenoxy)methyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[(4-bromo-2-fluoro-phenoxy)methyl]-2-methyl-3-furoic acid Formula: C13H10BrFO4 MolecularWeight: 329.118503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)COC2=C(C=C(C=C2)Br)F)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)COC2=C(C=C(C=C2)Br)F)C(=O)O

InChI

InChI=1S/C13H10BrFO4/c1-7-10(13(16)17)5-9(19-7)6-18-12-3-2-8(14)4-11(12)15/h2-5H,6H2,1H3,(H,16,17)