5-ethyl-2-(3-nitrophenyl)-4-propyl-1,3-dioxane

Systemtic Name: 5-ethyl-2-(3-nitrophenyl)-4-propyl-1,3-dioxane Openeye Name: 5-ethyl-2-(3-nitrophenyl)-4-propyl-1,3-dioxane CAS Name: 5-ethyl-2-(3-nitrophenyl)-4-propyl-1,3-dioxane IUPAC Name: 5-ethyl-2-(3-nitrophenyl)-4-propyl-1,3-dioxane Traditional Name: 5-ethyl-2-(3-nitrophenyl)-4-propyl-1,3-dioxane Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(COC(O1)C2=CC(=CC=C2)[N+](=O)[O-])CC

Isomeric SMILES

CCCC1C(COC(O1)C2=CC(=CC=C2)[N+](=O)[O-])CC

InChI

InChI=1S/C15H21NO4/c1-3-6-14-11(4-2)10-19-15(20-14)12-7-5-8-13(9-12)16(17)18/h5,7-9,11,14-15H,3-4,6,10H2,1-2H3