5-methyl-2-(2-methylsulfanylethyl)-5-nitro-1,3-dioxane

Systemtic Name: 5-methyl-2-(2-methylsulfanylethyl)-5-nitro-1,3-dioxane Openeye Name: 5-methyl-2-(2-methylsulfanylethyl)-5-nitro-1,3-dioxane CAS Name: 5-methyl-2-[2-(methylthio)ethyl]-5-nitro-1,3-dioxane IUPAC Name: 5-methyl-2-(2-methylsulfanylethyl)-5-nitro-1,3-dioxane Traditional Name: 5-methyl-2-[2-(methylthio)ethyl]-5-nitro-1,3-dioxane Formula: C8H15NO4S MolecularWeight: 221.274

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)CCSC)[N+](=O)[O-]

Isomeric SMILES

CC1(COC(OC1)CCSC)[N+](=O)[O-]

InChI

InChI=1S/C8H15NO4S/c1-8(9(10)11)5-12-7(13-6-8)3-4-14-2/h7H,3-6H2,1-2H3