5,5-dimethyl-2-(3-nitrophenyl)-1,3-dioxane

Systemtic Name: 5,5-dimethyl-2-(3-nitrophenyl)-1,3-dioxane Openeye Name: 5,5-dimethyl-2-(3-nitrophenyl)-1,3-dioxane CAS Name: 5,5-dimethyl-2-(3-nitrophenyl)-1,3-dioxane IUPAC Name: 5,5-dimethyl-2-(3-nitrophenyl)-1,3-dioxane Traditional Name: 5,5-dimethyl-2-(3-nitrophenyl)-1,3-dioxane Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)C2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1(COC(OC1)C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C12H15NO4/c1-12(2)7-16-11(17-8-12)9-4-3-5-10(6-9)13(14)15/h3-6,11H,7-8H2,1-2H3