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

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C18H17ClO6S MolecularWeight: 396.84198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClO6S/c1-11(20)12-4-7-17(24-2)13(8-12)10-25-18(21)15-9-14(26(3,22)23)5-6-16(15)19/h4-9H,10H2,1-3H3