2-(5-isocyano-3,4-dimethyl-2-oxidanyl-6-oxidanylidene-pyridin-1-yl)ethyl ethanoate

Systemtic Name: 2-(5-isocyano-3,4-dimethyl-2-oxidanyl-6-oxidanylidene-pyridin-1-yl)ethyl ethanoate Openeye Name: 2-(2-hydroxy-5-isocyano-3,4-dimethyl-6-oxo-1-pyridyl)ethyl acetate CAS Name: acetic acid 2-(2-hydroxy-5-isocyano-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl ester IUPAC Name: 2-(2-hydroxy-5-isocyano-3,4-dimethyl-6-oxopyridin-1-yl)ethyl acetate Traditional Name: acetic acid 2-(2-hydroxy-5-isocyano-6-keto-3,4-dimethyl-1-pyridyl)ethyl ester Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=C1C)O)CCOC(=O)C)[N+]#[C-]

Isomeric SMILES

CC1=C(C(=O)N(C(=C1C)O)CCOC(=O)C)[N+]#[C-]

InChI

InChI=1S/C12H14N2O4/c1-7-8(2)11(16)14(5-6-18-9(3)15)12(17)10(7)13-4/h16H,5-6H2,1-3H3