diethyl 2-nitro-2-(trifluoromethylsulfanyl)propanedioate

Systemtic Name: diethyl 2-nitro-2-(trifluoromethylsulfanyl)propanedioate Openeye Name: diethyl 2-nitro-2-(trifluoromethylsulfanyl)propanedioate CAS Name: 2-nitro-2-(trifluoromethylthio)propanedioic acid diethyl ester IUPAC Name: diethyl 2-nitro-2-(trifluoromethylsulfanyl)propanedioate Traditional Name: 2-nitro-2-(trifluoromethylthio)malonic acid diethyl ester Formula: C8H10F3NO6S MolecularWeight: 305.22831

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)([N+](=O)[O-])SC(F)(F)F

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)([N+](=O)[O-])SC(F)(F)F

InChI

InChI=1S/C8H10F3NO6S/c1-3-17-5(13)7(12(15)16,6(14)18-4-2)19-8(9,10)11/h3-4H2,1-2H3