diethyl (2S)-2-cyano-3-oxidanylidene-butanedioate

Systemtic Name: diethyl (2S)-2-cyano-3-oxidanylidene-butanedioate Openeye Name: diethyl (2S)-2-cyano-3-oxo-butanedioate CAS Name: (2S)-2-cyano-3-oxobutanedioic acid diethyl ester IUPAC Name: diethyl (2S)-2-cyano-3-oxobutanedioate Traditional Name: (2S)-2-cyano-3-keto-succinic acid diethyl ester Formula: C9H11NO5 MolecularWeight: 213.18734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)[C@@H](C#N)C(=O)C(=O)OCC

InChI

InChI=1S/C9H11NO5/c1-3-14-8(12)6(5-10)7(11)9(13)15-4-2/h6H,3-4H2,1-2H3/t6-/m0/s1