[2-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]-2-oxidanylidene-ethyl] 4-methylsulfonylbenzoate

Systemtic Name: [2-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]-2-oxidanylidene-ethyl] 4-methylsulfonylbenzoate Openeye Name: [2-[4-(difluoromethoxy)-3-methoxy-phenyl]-2-oxo-ethyl] 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [2-[4-(difluoromethoxy)-3-methoxyphenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(difluoromethoxy)-3-methoxyphenyl]-2-oxoethyl] 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [2-[4-(difluoromethoxy)-3-methoxy-phenyl]-2-keto-ethyl] ester Formula: C18H16F2O7S MolecularWeight: 414.377246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16F2O7S/c1-25-16-9-12(5-8-15(16)27-18(19)20)14(21)10-26-17(22)11-3-6-13(7-4-11)28(2,23)24/h3-9,18H,10H2,1-2H3