(E)-1,3-bis(azanyl)-3-oxidanylidene-2-pyridin-1-ium-1-yl-prop-1-en-1-olate

Systemtic Name: (E)-1,3-bis(azanyl)-3-oxidanylidene-2-pyridin-1-ium-1-yl-prop-1-en-1-olate Openeye Name: (E)-1,3-diamino-3-oxo-2-pyridin-1-ium-1-yl-prop-1-en-1-olate CAS Name: (E)-1,3-diamino-3-oxo-2-(1-pyridin-1-iumyl)-1-propen-1-olate IUPAC Name: (E)-1,3-diamino-3-oxo-2-pyridin-1-ium-1-ylprop-1-en-1-olate Traditional Name: (E)-1,3-diamino-3-keto-2-pyridin-1-ium-1-yl-prop-1-en-1-olate Formula: C8H9N3O2 MolecularWeight: 179.17596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H9N3O2/c9-7(12)6(8(10)13)11-4-2-1-3-5-11/h1-5H,(H4-,9,10,12,13)