methyl 7-methoxy-2-methyl-1-oxidanylidene-5-(trifluoromethylsulfonyloxy)-3H-isoindole-4-carboxylate

Systemtic Name: methyl 7-methoxy-2-methyl-1-oxidanylidene-5-(trifluoromethylsulfonyloxy)-3H-isoindole-4-carboxylate Openeye Name: methyl 7-methoxy-2-methyl-1-oxo-5-(trifluoromethylsulfonyloxy)isoindoline-4-carboxylate CAS Name: 7-methoxy-2-methyl-1-oxo-5-(trifluoromethylsulfonyloxy)-3H-isoindole-4-carboxylic acid methyl ester IUPAC Name: methyl 7-methoxy-2-methyl-1-oxo-5-(trifluoromethylsulfonyloxy)-3H-isoindole-4-carboxylate Traditional Name: 1-keto-7-methoxy-2-methyl-5-triflyloxy-isoindoline-4-carboxylic acid methyl ester Formula: C13H12F3NO7S MolecularWeight: 383.29709

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C1=O)C(=CC(=C2C(=O)OC)OS(=O)(=O)C(F)(F)F)OC

Isomeric SMILES

CN1CC2=C(C1=O)C(=CC(=C2C(=O)OC)OS(=O)(=O)C(F)(F)F)OC

InChI

InChI=1S/C13H12F3NO7S/c1-17-5-6-9(11(17)18)7(22-2)4-8(10(6)12(19)23-3)24-25(20,21)13(14,15)16/h4H,5H2,1-3H3