methyl 3-(2-bromoethyl)-2,4-dimethyl-6-oxidanyl-benzoate

Systemtic Name: methyl 3-(2-bromoethyl)-2,4-dimethyl-6-oxidanyl-benzoate Openeye Name: methyl 3-(2-bromoethyl)-6-hydroxy-2,4-dimethyl-benzoate CAS Name: 3-(2-bromoethyl)-6-hydroxy-2,4-dimethylbenzoic acid methyl ester IUPAC Name: methyl 3-(2-bromoethyl)-6-hydroxy-2,4-dimethylbenzoate Traditional Name: 3-(2-bromoethyl)-6-hydroxy-2,4-dimethyl-benzoic acid methyl ester Formula: C12H15BrO3 MolecularWeight: 287.1497

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CCBr)C)C(=O)OC)O

Isomeric SMILES

CC1=CC(=C(C(=C1CCBr)C)C(=O)OC)O

InChI

InChI=1S/C12H15BrO3/c1-7-6-10(14)11(12(15)16-3)8(2)9(7)4-5-13/h6,14H,4-5H2,1-3H3