(5S)-3-methyl-5-nitro-1,3,7-triazoniabicyclo[3.3.1]nonane

Systemtic Name: (5S)-3-methyl-5-nitro-1,3,7-triazoniabicyclo[3.3.1]nonane Openeye Name: (5S)-3-methyl-5-nitro-1,3,7-triazoniabicyclo[3.3.1]nonane CAS Name: (5S)-3-methyl-5-nitro-1,3,7-triazoniabicyclo[3.3.1]nonane IUPAC Name: (5S)-3-methyl-5-nitro-1,3,7-triazoniabicyclo[3.3.1]nonane Traditional Name: (5S)-3-methyl-5-nitro-1,3,7-triazoniabicyclo[3.3.1]nonane Formula: C7H17N4O2+3 MolecularWeight: 189.23548

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC2(C[NH2+]C[NH+](C2)C1)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1C[C@]2(C[NH2+]C[NH+](C2)C1)[N+](=O)[O-]

InChI

InChI=1S/C7H14N4O2/c1-9-3-7(11(12)13)2-8-5-10(4-7)6-9/h8H,2-6H2,1H3/p+3/t7-/m0/s1