methyl 5-bromanyl-3-methyl-2-oxidanyl-benzoate

Systemtic Name: methyl 5-bromanyl-3-methyl-2-oxidanyl-benzoate Openeye Name: methyl 5-bromo-2-hydroxy-3-methyl-benzoate CAS Name: 5-bromo-2-hydroxy-3-methylbenzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-hydroxy-3-methylbenzoate Traditional Name: 5-bromo-2-hydroxy-3-methyl-benzoic acid methyl ester Formula: C9H9BrO3 MolecularWeight: 245.06996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)OC)O

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)OC)O

InChI

InChI=1S/C9H9BrO3/c1-5-3-6(10)4-7(8(5)11)9(12)13-2/h3-4,11H,1-2H3