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

Systemtic Name: 5-[(4-bromanyl-3-methoxy-phenoxy)methyl]furan-2-carboxylic acid Openeye Name: 5-[(4-bromo-3-methoxy-phenoxy)methyl]furan-2-carboxylic acid CAS Name: 5-[(4-bromo-3-methoxyphenoxy)methyl]-2-furancarboxylic acid IUPAC Name: 5-[(4-bromo-3-methoxyphenoxy)methyl]furan-2-carboxylic acid Traditional Name: 5-[(4-bromo-3-methoxy-phenoxy)methyl]-2-furoic acid Formula: C13H11BrO5 MolecularWeight: 327.12744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCC2=CC=C(O2)C(=O)O)Br

Isomeric SMILES

COC1=C(C=CC(=C1)OCC2=CC=C(O2)C(=O)O)Br

InChI

InChI=1S/C13H11BrO5/c1-17-12-6-8(2-4-10(12)14)18-7-9-3-5-11(19-9)13(15)16/h2-6H,7H2,1H3,(H,15,16)