3-(bromomethyl)-2-methyl-4-methylsulfonyl-benzoate

Systemtic Name: 3-(bromomethyl)-2-methyl-4-methylsulfonyl-benzoate Openeye Name: 3-(bromomethyl)-2-methyl-4-methylsulfonyl-benzoate CAS Name: 3-(bromomethyl)-2-methyl-4-methylsulfonylbenzoate IUPAC Name: 3-(bromomethyl)-2-methyl-4-methylsulfonylbenzoate Traditional Name: 3-(bromomethyl)-4-mesyl-2-methyl-benzoate Formula: C10H10BrO4S- MolecularWeight: 306.153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1CBr)S(=O)(=O)C)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1CBr)S(=O)(=O)C)C(=O)[O-]

InChI

InChI=1S/C10H11BrO4S/c1-6-7(10(12)13)3-4-9(8(6)5-11)16(2,14)15/h3-4H,5H2,1-2H3,(H,12,13)/p-1