diethyl (3E)-2-cyano-3-[ethoxy(oxidanyl)methylidene]-4-oxidanylidene-cyclohexane-1,1-dicarboxylate

Systemtic Name: diethyl (3E)-2-cyano-3-[ethoxy(oxidanyl)methylidene]-4-oxidanylidene-cyclohexane-1,1-dicarboxylate Openeye Name: diethyl (3E)-2-cyano-3-[ethoxy(hydroxy)methylene]-4-oxo-cyclohexane-1,1-dicarboxylate CAS Name: (3E)-2-cyano-3-[ethoxy(hydroxy)methylidene]-4-oxocyclohexane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl (3E)-2-cyano-3-[ethoxy(hydroxy)methylidene]-4-oxocyclohexane-1,1-dicarboxylate Traditional Name: (3E)-2-cyano-3-[ethoxy(hydroxy)methylene]-4-keto-cyclohexane-1,1-dicarboxylic acid diethyl ester Formula: C16H21NO7 MolecularWeight: 339.34044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C1C(C(CCC1=O)(C(=O)OCC)C(=O)OCC)C#N)O

Isomeric SMILES

CCO/C(=C/1\C(C(CCC1=O)(C(=O)OCC)C(=O)OCC)C#N)/O

InChI

InChI=1S/C16H21NO7/c1-4-22-13(19)12-10(9-17)16(8-7-11(12)18,14(20)23-5-2)15(21)24-6-3/h10,19H,4-8H2,1-3H3/b13-12+