5-(5-ethyl-5-nitro-1,3-dioxan-2-yl)-1,3-benzodioxole

Systemtic Name: 5-(5-ethyl-5-nitro-1,3-dioxan-2-yl)-1,3-benzodioxole Openeye Name: 5-(5-ethyl-5-nitro-1,3-dioxan-2-yl)-1,3-benzodioxole CAS Name: 5-(5-ethyl-5-nitro-1,3-dioxan-2-yl)-1,3-benzodioxole IUPAC Name: 5-(5-ethyl-5-nitro-1,3-dioxan-2-yl)-1,3-benzodioxole Traditional Name: 5-(5-ethyl-5-nitro-1,3-dioxan-2-yl)-1,3-benzodioxole Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(COC(OC1)C2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CCC1(COC(OC1)C2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C13H15NO6/c1-2-13(14(15)16)6-17-12(18-7-13)9-3-4-10-11(5-9)20-8-19-10/h3-5,12H,2,6-8H2,1H3