ethyl 2-cyano-2-(1-cyano-2-ethyl-3-oxidanylidene-isoindol-1-yl)ethanoate

Systemtic Name: ethyl 2-cyano-2-(1-cyano-2-ethyl-3-oxidanylidene-isoindol-1-yl)ethanoate Openeye Name: ethyl 2-cyano-2-(1-cyano-2-ethyl-3-oxo-isoindolin-1-yl)acetate CAS Name: 2-cyano-2-(1-cyano-2-ethyl-3-oxo-1-isoindolyl)acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(1-cyano-2-ethyl-3-oxoisoindol-1-yl)acetate Traditional Name: 2-cyano-2-(1-cyano-2-ethyl-3-keto-isoindolin-1-yl)acetic acid ethyl ester Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C1(C#N)C(C#N)C(=O)OCC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C1(C#N)C(C#N)C(=O)OCC

InChI

InChI=1S/C16H15N3O3/c1-3-19-14(20)11-7-5-6-8-12(11)16(19,10-18)13(9-17)15(21)22-4-2/h5-8,13H,3-4H2,1-2H3