2-[[(E)-N'-nitrocarbamimidoyl]-nitroso-amino]ethyl ethanoate

Systemtic Name: 2-[[(E)-N'-nitrocarbamimidoyl]-nitroso-amino]ethyl ethanoate Openeye Name: 2-[[(E)-N'-nitrocarbamimidoyl]-nitroso-amino]ethyl acetate CAS Name: acetic acid 2-[[(E)-amino(nitroimino)methyl]-nitrosoamino]ethyl ester IUPAC Name: 2-[[(E)-N'-nitrocarbamimidoyl]-nitrosoamino]ethyl acetate Traditional Name: acetic acid 2-[[(E)-N'-nitroamidino]-nitroso-amino]ethyl ester Formula: C5H9N5O5 MolecularWeight: 219.15546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN(C(=N[N+](=O)[O-])N)N=O

Isomeric SMILES

CC(=O)OCCN(/C(=N/[N+](=O)[O-])/N)N=O

InChI

InChI=1S/C5H9N5O5/c1-4(11)15-3-2-9(8-12)5(6)7-10(13)14/h2-3H2,1H3,(H2,6,7)