(E)-1-cyano-1-nitro-prop-1-en-2-olate; pyridin-1-ium

Systemtic Name: (E)-1-cyano-1-nitro-prop-1-en-2-olate; pyridin-1-ium Openeye Name: (E)-1-cyano-1-nitro-prop-1-en-2-olate; pyridin-1-ium CAS Name: (E)-1-cyano-1-nitro-1-propen-2-olate; pyridin-1-ium IUPAC Name: (E)-1-cyano-1-nitroprop-1-en-2-olate; pyridin-1-ium Traditional Name: (E)-1-cyano-1-nitro-prop-1-en-2-olate; pyridin-1-ium Formula: C9H9N3O3 MolecularWeight: 207.18606

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)[N+](=O)[O-])[O-].C1=CC=[NH+]C=C1

Isomeric SMILES

C/C(=C(/C#N)\[N+](=O)[O-])/[O-].C1=CC=[NH+]C=C1

InChI

InChI=1S/C5H5N.C4H4N2O3/c1-2-4-6-5-3-1;1-3(7)4(2-5)6(8)9/h1-5H;7H,1H3/b;4-3+