5,6-dinitrospiro[1,3-benzodioxole-2,1'-cycloheptane]

Systemtic Name: 5,6-dinitrospiro[1,3-benzodioxole-2,1'-cycloheptane] Openeye Name: 5,6-dinitrospiro[1,3-benzodioxole-2,1'-cycloheptane] CAS Name: 5,6-dinitrospiro[1,3-benzodioxole-2,1'-cycloheptane] IUPAC Name: 5,6-dinitrospiro[1,3-benzodioxole-2,1'-cycloheptane] Traditional Name: 5,6-dinitrospiro[1,3-benzodioxole-2,1'-cycloheptane] Formula: C13H14N2O6 MolecularWeight: 294.26006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2(CC1)OC3=C(O2)C=C(C(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCCC2(CC1)OC3=C(O2)C=C(C(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O6/c16-14(17)9-7-11-12(8-10(9)15(18)19)21-13(20-11)5-3-1-2-4-6-13/h7-8H,1-6H2