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

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: (5-bromo-2-methoxy-phenyl)methyl 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid (5-bromo-2-methoxyphenyl)methyl ester IUPAC Name: (5-bromo-2-methoxyphenyl)methyl 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-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=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

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

InChI

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