methyl 3-bromanyl-5-methoxy-4-oxidanyl-benzoate

Systemtic Name: methyl 3-bromanyl-5-methoxy-4-oxidanyl-benzoate Openeye Name: methyl 3-bromo-4-hydroxy-5-methoxy-benzoate CAS Name: 3-bromo-4-hydroxy-5-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-hydroxy-5-methoxybenzoate Traditional Name: 3-bromo-4-hydroxy-5-methoxy-benzoic acid methyl ester Formula: C9H9BrO4 MolecularWeight: 261.06936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9BrO4/c1-13-7-4-5(9(12)14-2)3-6(10)8(7)11/h3-4,11H,1-2H3