3-[[(E)-N'-nitrocarbamimidoyl]-nitroso-amino]propyl ethanoate

Systemtic Name: 3-[[(E)-N'-nitrocarbamimidoyl]-nitroso-amino]propyl ethanoate Openeye Name: 3-[[(E)-N'-nitrocarbamimidoyl]-nitroso-amino]propyl acetate CAS Name: acetic acid 3-[[(E)-amino(nitroimino)methyl]-nitrosoamino]propyl ester IUPAC Name: 3-[[(E)-N'-nitrocarbamimidoyl]-nitrosoamino]propyl acetate Traditional Name: acetic acid 3-[[(E)-N'-nitroamidino]-nitroso-amino]propyl ester Formula: C6H11N5O5 MolecularWeight: 233.18204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H11N5O5/c1-5(12)16-4-2-3-10(9-13)6(7)8-11(14)15/h2-4H2,1H3,(H2,7,8)