2-ethyl-2,5-dimethyl-5-nitro-1,3-dioxane

Systemtic Name: 2-ethyl-2,5-dimethyl-5-nitro-1,3-dioxane Openeye Name: 2-ethyl-2,5-dimethyl-5-nitro-1,3-dioxane CAS Name: 2-ethyl-2,5-dimethyl-5-nitro-1,3-dioxane IUPAC Name: 2-ethyl-2,5-dimethyl-5-nitro-1,3-dioxane Traditional Name: 2-ethyl-2,5-dimethyl-5-nitro-1,3-dioxane Formula: C8H15NO4 MolecularWeight: 189.209

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(OCC(CO1)(C)[N+](=O)[O-])C

Isomeric SMILES

CCC1(OCC(CO1)(C)[N+](=O)[O-])C

InChI

InChI=1S/C8H15NO4/c1-4-8(3)12-5-7(2,6-13-8)9(10)11/h4-6H2,1-3H3