[5-methoxy-2-(phenylcarbonyl)phenyl] 2-chloranyl-5-methylsulfonyl-benzenesulfonate

Systemtic Name: [5-methoxy-2-(phenylcarbonyl)phenyl] 2-chloranyl-5-methylsulfonyl-benzenesulfonate Openeye Name: (2-benzoyl-5-methoxy-phenyl) 2-chloro-5-methylsulfonyl-benzenesulfonate CAS Name: 2-chloro-5-methylsulfonylbenzenesulfonic acid (2-benzoyl-5-methoxyphenyl) ester IUPAC Name: (2-benzoyl-5-methoxyphenyl) 2-chloro-5-methylsulfonylbenzenesulfonate Traditional Name: 2-chloro-5-mesyl-benzenesulfonic acid (2-benzoyl-5-methoxy-phenyl) ester Formula: C21H17ClO7S2 MolecularWeight: 480.93848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)OS(=O)(=O)C3=C(C=CC(=C3)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)OS(=O)(=O)C3=C(C=CC(=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C21H17ClO7S2/c1-28-15-8-10-17(21(23)14-6-4-3-5-7-14)19(12-15)29-31(26,27)20-13-16(30(2,24)25)9-11-18(20)22/h3-13H,1-2H3