2-(4,6-dimethyl-3-nitro-2-oxidanylidene-pyridin-1-yl)ethanoic acid

Systemtic Name: 2-(4,6-dimethyl-3-nitro-2-oxidanylidene-pyridin-1-yl)ethanoic acid Openeye Name: 2-(4,6-dimethyl-3-nitro-2-oxo-1-pyridyl)acetic acid CAS Name: 2-(4,6-dimethyl-3-nitro-2-oxo-1-pyridinyl)acetic acid IUPAC Name: 2-(4,6-dimethyl-3-nitro-2-oxopyridin-1-yl)acetic acid Traditional Name: 2-(2-keto-4,6-dimethyl-3-nitro-1-pyridyl)acetic acid Formula: C9H10N2O5 MolecularWeight: 226.1861

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1CC(=O)O)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=O)N1CC(=O)O)[N+](=O)[O-])C

InChI

InChI=1S/C9H10N2O5/c1-5-3-6(2)10(4-7(12)13)9(14)8(5)11(15)16/h3H,4H2,1-2H3,(H,12,13)