ethyl 5-bromanyl-3-methyl-4-methylsulfanyl-2-oxidanyl-benzoate

Systemtic Name: ethyl 5-bromanyl-3-methyl-4-methylsulfanyl-2-oxidanyl-benzoate Openeye Name: ethyl 5-bromo-2-hydroxy-3-methyl-4-methylsulfanyl-benzoate CAS Name: 5-bromo-2-hydroxy-3-methyl-4-(methylthio)benzoic acid ethyl ester IUPAC Name: ethyl 5-bromo-2-hydroxy-3-methyl-4-methylsulfanylbenzoate Traditional Name: 5-bromo-2-hydroxy-3-methyl-4-(methylthio)benzoic acid ethyl ester Formula: C11H13BrO3S MolecularWeight: 305.18812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1O)C)SC)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1O)C)SC)Br

InChI

InChI=1S/C11H13BrO3S/c1-4-15-11(14)7-5-8(12)10(16-3)6(2)9(7)13/h5,13H,4H2,1-3H3