4-nitro-5-pyridin-1-ium-1-yl-benzene-1,2-dicarbonitrile

Systemtic Name: 4-nitro-5-pyridin-1-ium-1-yl-benzene-1,2-dicarbonitrile Openeye Name: 4-nitro-5-pyridin-1-ium-1-yl-phthalonitrile CAS Name: 4-nitro-5-(1-pyridin-1-iumyl)benzene-1,2-dicarbonitrile IUPAC Name: 4-nitro-5-pyridin-1-ium-1-ylbenzene-1,2-dicarbonitrile Traditional Name: 4-nitro-5-pyridin-1-ium-1-yl-phthalonitrile Formula: C13H7N4O2+ MolecularWeight: 251.22028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7N4O2/c14-8-10-6-12(16-4-2-1-3-5-16)13(17(18)19)7-11(10)9-15/h1-7H/q+1