(E)-2-diazonio-2-nitro-1-[(1S,2R)-2-phenylcyclohexyl]oxy-ethenolate

Systemtic Name: (E)-2-diazonio-2-nitro-1-[(1S,2R)-2-phenylcyclohexyl]oxy-ethenolate Openeye Name: (E)-2-diazonio-2-nitro-1-[(1S,2R)-2-phenylcyclohexoxy]ethenolate CAS Name: (E)-2-diazonio-2-nitro-1-[(1S,2R)-2-phenylcyclohexyl]oxyethenolate IUPAC Name: (E)-2-diazonio-2-nitro-1-[(1S,2R)-2-phenylcyclohexyl]oxyethenolate Traditional Name: (E)-2-diazonio-2-nitro-1-[(1S,2R)-2-phenylcyclohexoxy]ethenolate Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C2=CC=CC=C2)OC(=C([N+]#N)[N+](=O)[O-])[O-]

Isomeric SMILES

C1CC[C@@H]([C@H](C1)C2=CC=CC=C2)O/C(=C(\[N+]#N)/[N+](=O)[O-])/[O-]

InChI

InChI=1S/C14H15N3O4/c15-16-13(17(19)20)14(18)21-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11-12H,4-5,8-9H2/b14-13+/t11-,12+/m1/s1