3-[4-(diethylamino)-3-nitro-phenyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-[4-(diethylamino)-3-nitro-phenyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-[4-(diethylamino)-3-nitro-phenyl]oxadiazol-3-ium-5-olate CAS Name: 3-[4-(diethylamino)-3-nitrophenyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[4-(diethylamino)-3-nitrophenyl]oxadiazol-3-ium-5-olate Traditional Name: 3-[4-(diethylamino)-3-nitro-phenyl]oxadiazol-3-ium-5-olate Formula: C12H14N4O4 MolecularWeight: 278.26396

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)[N+]2=NOC(=C2)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)[N+]2=NOC(=C2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O4/c1-3-14(4-2)10-6-5-9(7-11(10)16(18)19)15-8-12(17)20-13-15/h5-8H,3-4H2,1-2H3