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

Systemtic Name: 3-(bromomethyl)-2-chloranyl-4-methylsulfonyl-benzoate Openeye Name: 3-(bromomethyl)-2-chloro-4-methylsulfonyl-benzoate CAS Name: 3-(bromomethyl)-2-chloro-4-methylsulfonylbenzoate IUPAC Name: 3-(bromomethyl)-2-chloro-4-methylsulfonylbenzoate Traditional Name: 3-(bromomethyl)-2-chloro-4-mesyl-benzoate Formula: C9H7BrClO4S- MolecularWeight: 326.57148

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)[O-])Cl)CBr

Isomeric SMILES

CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)[O-])Cl)CBr

InChI

InChI=1S/C9H8BrClO4S/c1-16(14,15)7-3-2-5(9(12)13)8(11)6(7)4-10/h2-3H,4H2,1H3,(H,12,13)/p-1