(5-bromanyl-2-methoxy-phenyl)methyl 4-chloranyl-3-methylsulfonyl-benzoate

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl 4-chloranyl-3-methylsulfonyl-benzoate Openeye Name: (5-bromo-2-methoxy-phenyl)methyl 4-chloro-3-methylsulfonyl-benzoate CAS Name: 4-chloro-3-methylsulfonylbenzoic acid (5-bromo-2-methoxyphenyl)methyl ester IUPAC Name: (5-bromo-2-methoxyphenyl)methyl 4-chloro-3-methylsulfonylbenzoate Traditional Name: 4-chloro-3-mesyl-benzoic acid (5-bromo-2-methoxy-benzyl) ester Formula: C16H14BrClO5S MolecularWeight: 433.70136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)Br)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C16H14BrClO5S/c1-22-14-6-4-12(17)7-11(14)9-23-16(19)10-3-5-13(18)15(8-10)24(2,20)21/h3-8H,9H2,1-2H3