FUR

Furazolidone

Created:2003-01-21
Last modified:  2012-08-08

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Chemical Details

Formal Charge0
Atom Count21
Chiral Atom Count0
Bond Count22
Aromatic Bond Count10
2D diagram of FUR

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Chemical Component Summary

NameFurazolidone
Systematic Name (OpenEye OEToolkits)3-[(5-nitrofuran-2-yl)methylideneamino]-1,3-oxazol-2-one
FormulaC8 H5 N3 O5
Molecular Weight223.142
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C2OC=CN2/N=C/c1oc([N+]([O-])=O)cc1
SMILESCACTVS3.341[O-][N+](=O)c1oc(cc1)C=NN2C=COC2=O
SMILESOpenEye OEToolkits1.5.0c1cc(oc1C=NN2C=COC2=O)[N+](=O)[O-]
Canonical SMILESCACTVS3.341 [O-][N+](=O)c1oc(cc1)\C=N\N2C=COC2=O
Canonical SMILESOpenEye OEToolkits1.5.0 c1cc(oc1C=NN2C=COC2=O)[N+](=O)[O-]
InChIInChI1.03 InChI=1S/C8H5N3O5/c12-8-10(3-4-15-8)9-5-6-1-2-7(16-6)11(13)14/h1-5H/b9-5+
InChIKeyInChI1.03 OEJYWOUVKXLNIN-WEVVVXLNSA-N

Related Resource References

Resource NameReference
PubChem 45480538
ChEBI CHEBI:42603