3-(2-isothiocyanato-2-oxidanylidene-ethyl)-2,2-bis(trifluoromethyl)-1,3-oxazolidin-5-one

Systemtic Name: 3-(2-isothiocyanato-2-oxidanylidene-ethyl)-2,2-bis(trifluoromethyl)-1,3-oxazolidin-5-one Openeye Name: 2-[5-oxo-2,2-bis(trifluoromethyl)oxazolidin-3-yl]acetyl isothiocyanate CAS Name: 3-(2-isothiocyanato-2-oxoethyl)-2,2-bis(trifluoromethyl)-5-oxazolidinone IUPAC Name: 2-[5-oxo-2,2-bis(trifluoromethyl)-1,3-oxazolidin-3-yl]acetyl isothiocyanate Traditional Name: 3-(2-isothiocyanato-2-keto-ethyl)-2,2-bis(trifluoromethyl)oxazolidin-5-one Formula: C8H4F6N2O3S MolecularWeight: 322.184379

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)OC(N1CC(=O)N=C=S)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1C(=O)OC(N1CC(=O)N=C=S)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C8H4F6N2O3S/c9-7(10,11)6(8(12,13)14)16(2-5(18)19-6)1-4(17)15-3-20/h1-2H2