2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)ethanoic acid

Systemtic Name: 2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)ethanoic acid Openeye Name: 2-(3-bromo-4-hydroxy-5-methoxy-phenyl)acetic acid CAS Name: 2-(3-bromo-4-hydroxy-5-methoxyphenyl)acetic acid IUPAC Name: 2-(3-bromo-4-hydroxy-5-methoxyphenyl)acetic acid Traditional Name: 2-(3-bromo-4-hydroxy-5-methoxy-phenyl)acetic acid Formula: C9H9BrO4 MolecularWeight: 261.06936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9BrO4/c1-14-7-3-5(4-8(11)12)2-6(10)9(7)13/h2-3,13H,4H2,1H3,(H,11,12)