[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2,5-dimethylfuran-3-carboxylate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2,5-dimethylfuran-3-carboxylate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2,5-dimethylfuran-3-carboxylate CAS Name: 2,5-dimethyl-3-furancarboxylic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2,5-dimethylfuran-3-carboxylate Traditional Name: 2,5-dimethylfuran-3-carboxylic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)OCC(=O)C(=C(C)N)C#N

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)OCC(=O)/C(=C(\C)/N)/C#N

InChI

InChI=1S/C13H14N2O4/c1-7-4-10(9(3)19-7)13(17)18-6-12(16)11(5-14)8(2)15/h4H,6,15H2,1-3H3/b11-8+