(E)-2-diazonio-1-[(1R,2S,5S)-2-methyl-5-propan-2-yl-cyclohexyl]oxy-2-nitro-ethenolate

Systemtic Name: (E)-2-diazonio-1-[(1R,2S,5S)-2-methyl-5-propan-2-yl-cyclohexyl]oxy-2-nitro-ethenolate Openeye Name: (E)-2-diazonio-1-[(1R,2S,5S)-5-isopropyl-2-methyl-cyclohexoxy]-2-nitro-ethenolate CAS Name: (E)-2-diazonio-1-[(1R,2S,5S)-2-methyl-5-propan-2-ylcyclohexyl]oxy-2-nitroethenolate IUPAC Name: (E)-2-diazonio-1-[(1R,2S,5S)-2-methyl-5-propan-2-ylcyclohexyl]oxy-2-nitroethenolate Traditional Name: (E)-2-diazonio-1-[(1R,2S,5S)-5-isopropyl-2-methyl-cyclohexoxy]-2-nitro-ethenolate Formula: C12H19N3O4 MolecularWeight: 269.29696

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1OC(=C([N+]#N)[N+](=O)[O-])[O-])C(C)C

Isomeric SMILES

C[C@H]1CC[C@@H](C[C@H]1O/C(=C(\[N+]#N)/[N+](=O)[O-])/[O-])C(C)C

InChI

InChI=1S/C12H19N3O4/c1-7(2)9-5-4-8(3)10(6-9)19-12(16)11(14-13)15(17)18/h7-10H,4-6H2,1-3H3/b12-11+/t8-,9-,10+/m0/s1