2-(2-chlorophenyl)-5-ethyl-5-nitro-1,3-dioxane

Systemtic Name: 2-(2-chlorophenyl)-5-ethyl-5-nitro-1,3-dioxane Openeye Name: 2-(2-chlorophenyl)-5-ethyl-5-nitro-1,3-dioxane CAS Name: 2-(2-chlorophenyl)-5-ethyl-5-nitro-1,3-dioxane IUPAC Name: 2-(2-chlorophenyl)-5-ethyl-5-nitro-1,3-dioxane Traditional Name: 2-(2-chlorophenyl)-5-ethyl-5-nitro-1,3-dioxane Formula: C12H14ClNO4 MolecularWeight: 271.69686

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(COC(OC1)C2=CC=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

CCC1(COC(OC1)C2=CC=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H14ClNO4/c1-2-12(14(15)16)7-17-11(18-8-12)9-5-3-4-6-10(9)13/h3-6,11H,2,7-8H2,1H3