2,2-dimethyl-5-nitro-5-[2-[3-nitro-4-[(E)-oct-1-enyl]phenyl]ethyl]-1,3-dioxane

Systemtic Name: 2,2-dimethyl-5-nitro-5-[2-[3-nitro-4-[(E)-oct-1-enyl]phenyl]ethyl]-1,3-dioxane Openeye Name: 2,2-dimethyl-5-nitro-5-[2-[3-nitro-4-[(E)-oct-1-enyl]phenyl]ethyl]-1,3-dioxane CAS Name: 2,2-dimethyl-5-nitro-5-[2-[3-nitro-4-[(E)-oct-1-enyl]phenyl]ethyl]-1,3-dioxane IUPAC Name: 2,2-dimethyl-5-nitro-5-[2-[3-nitro-4-[(E)-oct-1-enyl]phenyl]ethyl]-1,3-dioxane Traditional Name: 2,2-dimethyl-5-nitro-5-[2-[3-nitro-4-[(E)-oct-1-enyl]phenyl]ethyl]-1,3-dioxane Formula: C22H32N2O6 MolecularWeight: 420.49928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1=C(C=C(C=C1)CCC2(COC(OC2)(C)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCC/C=C/C1=C(C=C(C=C1)CCC2(COC(OC2)(C)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H32N2O6/c1-4-5-6-7-8-9-10-19-12-11-18(15-20(19)23(25)26)13-14-22(24(27)28)16-29-21(2,3)30-17-22/h9-12,15H,4-8,13-14,16-17H2,1-3H3/b10-9+