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

Systemtic Name: 5-bromanyl-3-methyl-2-oxidanyl-benzoate Openeye Name: 5-bromo-2-hydroxy-3-methyl-benzoate CAS Name: 5-bromo-2-hydroxy-3-methylbenzoate IUPAC Name: 5-bromo-2-hydroxy-3-methylbenzoate Traditional Name: 5-bromo-2-hydroxy-3-methyl-benzoate Formula: C8H6BrO3- MolecularWeight: 230.03544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)[O-])O

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)[O-])O

InChI

InChI=1S/C8H7BrO3/c1-4-2-5(9)3-6(7(4)10)8(11)12/h2-3,10H,1H3,(H,11,12)/p-1