(2,5-dimethoxyphenyl)methyl 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: (2,5-dimethoxyphenyl)methyl 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: (2,5-dimethoxyphenyl)methyl 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid (2,5-dimethoxyphenyl)methyl ester IUPAC Name: (2,5-dimethoxyphenyl)methyl 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid (2,5-dimethoxybenzyl) ester Formula: C17H17ClO6S MolecularWeight: 384.83128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClO6S/c1-22-12-4-7-16(23-2)11(8-12)10-24-17(19)14-9-13(25(3,20)21)5-6-15(14)18/h4-9H,10H2,1-3H3