(6-methyl-3-nitro-2-oxidanylidene-1H-pyridin-4-yl) 2-ethylbutanoate

Systemtic Name: (6-methyl-3-nitro-2-oxidanylidene-1H-pyridin-4-yl) 2-ethylbutanoate Openeye Name: (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) 2-ethylbutanoate CAS Name: 2-ethylbutanoic acid (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) ester IUPAC Name: (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) 2-ethylbutanoate Traditional Name: 2-ethylbutyric acid (2-keto-6-methyl-3-nitro-1H-pyridin-4-yl) ester Formula: C12H16N2O5 MolecularWeight: 268.26584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)OC1=C(C(=O)NC(=C1)C)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)C(=O)OC1=C(C(=O)NC(=C1)C)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O5/c1-4-8(5-2)12(16)19-9-6-7(3)13-11(15)10(9)14(17)18/h6,8H,4-5H2,1-3H3,(H,13,15)