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

Systemtic Name: 4-[(4-bromanyl-3-methoxy-phenoxy)methyl]-5-methyl-furan-2-carboxylic acid Openeye Name: 4-[(4-bromo-3-methoxy-phenoxy)methyl]-5-methyl-furan-2-carboxylic acid CAS Name: 4-[(4-bromo-3-methoxyphenoxy)methyl]-5-methyl-2-furancarboxylic acid IUPAC Name: 4-[(4-bromo-3-methoxyphenoxy)methyl]-5-methylfuran-2-carboxylic acid Traditional Name: 4-[(4-bromo-3-methoxy-phenoxy)methyl]-5-methyl-2-furoic acid Formula: C14H13BrO5 MolecularWeight: 341.15402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)O)COC2=CC(=C(C=C2)Br)OC

Isomeric SMILES

CC1=C(C=C(O1)C(=O)O)COC2=CC(=C(C=C2)Br)OC

InChI

InChI=1S/C14H13BrO5/c1-8-9(5-13(20-8)14(16)17)7-19-10-3-4-11(15)12(6-10)18-2/h3-6H,7H2,1-2H3,(H,16,17)