2-cyano-2-(3-nitropyridin-2-yl)ethanoic acid

Systemtic Name: 2-cyano-2-(3-nitropyridin-2-yl)ethanoic acid Openeye Name: 2-cyano-2-(3-nitro-2-pyridyl)acetic acid CAS Name: 2-cyano-2-(3-nitro-2-pyridinyl)acetic acid IUPAC Name: 2-cyano-2-(3-nitropyridin-2-yl)acetic acid Traditional Name: 2-cyano-2-(3-nitro-2-pyridyl)acetic acid Formula: C8H5N3O4 MolecularWeight: 207.143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H5N3O4/c9-4-5(8(12)13)7-6(11(14)15)2-1-3-10-7/h1-3,5H,(H,12,13)