methyl 3-bromanyl-2,6-dimethyl-benzoate

Systemtic Name: methyl 3-bromanyl-2,6-dimethyl-benzoate Openeye Name: methyl 3-bromo-2,6-dimethyl-benzoate CAS Name: 3-bromo-2,6-dimethylbenzoic acid methyl ester IUPAC Name: methyl 3-bromo-2,6-dimethylbenzoate Traditional Name: 3-bromo-2,6-dimethyl-benzoic acid methyl ester Formula: C10H11BrO2 MolecularWeight: 243.09714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11BrO2/c1-6-4-5-8(11)7(2)9(6)10(12)13-3/h4-5H,1-3H3