2,2-dimethyl-5-nitro-5-[(2-nitrophenyl)methyl]-1,3-dioxane

Systemtic Name: 2,2-dimethyl-5-nitro-5-[(2-nitrophenyl)methyl]-1,3-dioxane Openeye Name: 2,2-dimethyl-5-nitro-5-[(2-nitrophenyl)methyl]-1,3-dioxane CAS Name: 2,2-dimethyl-5-nitro-5-[(2-nitrophenyl)methyl]-1,3-dioxane IUPAC Name: 2,2-dimethyl-5-nitro-5-[(2-nitrophenyl)methyl]-1,3-dioxane Traditional Name: 2,2-dimethyl-5-nitro-5-(2-nitrobenzyl)-1,3-dioxane Formula: C13H16N2O6 MolecularWeight: 296.27594

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)(CC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1(OCC(CO1)(CC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C13H16N2O6/c1-12(2)20-8-13(9-21-12,15(18)19)7-10-5-3-4-6-11(10)14(16)17/h3-6H,7-9H2,1-2H3