3-[5-[(Z)-(N'-nitrocarbamimidoyl)azanidyliminomethyl]furan-2-yl]benzoate

Systemtic Name: 3-[5-[(Z)-(N'-nitrocarbamimidoyl)azanidyliminomethyl]furan-2-yl]benzoate Openeye Name: 3-[5-[(Z)-(N'-nitrocarbamimidoyl)azanidyliminomethyl]-2-furyl]benzoate CAS Name: 3-[5-[(Z)-[amino(nitroimino)methyl]azanidyliminomethyl]-2-furanyl]benzoate IUPAC Name: 3-[5-[(Z)-(N'-nitrocarbamimidoyl)azanidyliminomethyl]furan-2-yl]benzoate Traditional Name: 3-[5-[(Z)-(N'-nitroamidino)azanidyliminomethyl]-2-furyl]benzoate Formula: C13H9N5O5-2 MolecularWeight: 315.24106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)[O-])C2=CC=C(O2)C=N[N-]C(=N[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)[O-])C2=CC=C(O2)/C=N\[N-]C(=N[N+](=O)[O-])N

InChI

InChI=1S/C13H11N5O5/c14-13(17-18(21)22)16-15-7-10-4-5-11(23-10)8-2-1-3-9(6-8)12(19)20/h1-7H,(H4,14,16,17,19,20)/p-2/b15-7-