methyl 5-bromanyl-4-methyl-2-oxidanyl-benzoate

Systemtic Name: methyl 5-bromanyl-4-methyl-2-oxidanyl-benzoate Openeye Name: methyl 5-bromo-2-hydroxy-4-methyl-benzoate CAS Name: 5-bromo-2-hydroxy-4-methylbenzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-hydroxy-4-methylbenzoate Traditional Name: 5-bromo-2-hydroxy-4-methyl-benzoic acid methyl ester Formula: C9H9BrO3 MolecularWeight: 245.06996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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