(1R,2S)-2-(3,5-dinitro-1,2,4-triazol-1-yl)cyclohexan-1-ol

Systemtic Name: (1R,2S)-2-(3,5-dinitro-1,2,4-triazol-1-yl)cyclohexan-1-ol Openeye Name: (1R,2S)-2-(3,5-dinitro-1,2,4-triazol-1-yl)cyclohexanol CAS Name: (1R,2S)-2-(3,5-dinitro-1,2,4-triazol-1-yl)-1-cyclohexanol IUPAC Name: (1R,2S)-2-(3,5-dinitro-1,2,4-triazol-1-yl)cyclohexan-1-ol Traditional Name: (1R,2S)-2-(3,5-dinitro-1,2,4-triazol-1-yl)cyclohexanol Formula: C8H11N5O5 MolecularWeight: 257.20344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N2C(=NC(=N2)[N+](=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

C1CC[C@H]([C@H](C1)N2C(=NC(=N2)[N+](=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C8H11N5O5/c14-6-4-2-1-3-5(6)11-8(13(17)18)9-7(10-11)12(15)16/h5-6,14H,1-4H2/t5-,6+/m0/s1