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

Systemtic Name: 5-ethyl-5-nitro-2-(1-phenylethyl)-1,3-dioxane Openeye Name: 5-ethyl-5-nitro-2-(1-phenylethyl)-1,3-dioxane CAS Name: 5-ethyl-5-nitro-2-(1-phenylethyl)-1,3-dioxane IUPAC Name: 5-ethyl-5-nitro-2-(1-phenylethyl)-1,3-dioxane Traditional Name: 5-ethyl-5-nitro-2-(1-phenylethyl)-1,3-dioxane Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO4/c1-3-14(15(16)17)9-18-13(19-10-14)11(2)12-7-5-4-6-8-12/h4-8,11,13H,3,9-10H2,1-2H3