methyl 3-(2-bromoethyl)-4-methyl-benzoate

Systemtic Name: methyl 3-(2-bromoethyl)-4-methyl-benzoate Openeye Name: methyl 3-(2-bromoethyl)-4-methyl-benzoate CAS Name: 3-(2-bromoethyl)-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-(2-bromoethyl)-4-methylbenzoate Traditional Name: 3-(2-bromoethyl)-4-methyl-benzoic acid methyl ester Formula: C11H13BrO2 MolecularWeight: 257.12372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13BrO2/c1-8-3-4-10(11(13)14-2)7-9(8)5-6-12/h3-4,7H,5-6H2,1-2H3