(E)-4-methyl-6-(5-nitro-2-oxidanylidene-pyridin-1-yl)hex-4-enoic acid

Systemtic Name: (E)-4-methyl-6-(5-nitro-2-oxidanylidene-pyridin-1-yl)hex-4-enoic acid Openeye Name: (E)-4-methyl-6-(5-nitro-2-oxo-1-pyridyl)hex-4-enoic acid CAS Name: (E)-4-methyl-6-(5-nitro-2-oxo-1-pyridinyl)-4-hexenoic acid IUPAC Name: (E)-4-methyl-6-(5-nitro-2-oxopyridin-1-yl)hex-4-enoic acid Traditional Name: (E)-6-(2-keto-5-nitro-1-pyridyl)-4-methyl-hex-4-enoic acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C=C(C=CC1=O)[N+](=O)[O-])CCC(=O)O

Isomeric SMILES

C/C(=C\CN1C=C(C=CC1=O)[N+](=O)[O-])/CCC(=O)O

InChI

InChI=1S/C12H14N2O5/c1-9(2-5-12(16)17)6-7-13-8-10(14(18)19)3-4-11(13)15/h3-4,6,8H,2,5,7H2,1H3,(H,16,17)/b9-6+