ethyl 2-cyano-2-(1-cyano-2,4-dimethyl-3-oxidanylidene-isoindol-1-yl)ethanoate

Systemtic Name: ethyl 2-cyano-2-(1-cyano-2,4-dimethyl-3-oxidanylidene-isoindol-1-yl)ethanoate Openeye Name: ethyl 2-cyano-2-(1-cyano-2,4-dimethyl-3-oxo-isoindolin-1-yl)acetate CAS Name: 2-cyano-2-(1-cyano-2,4-dimethyl-3-oxo-1-isoindolyl)acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(1-cyano-2,4-dimethyl-3-oxoisoindol-1-yl)acetate Traditional Name: 2-cyano-2-(1-cyano-3-keto-2,4-dimethyl-isoindolin-1-yl)acetic acid ethyl ester Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1(C2=C(C(=CC=C2)C)C(=O)N1C)C#N

Isomeric SMILES

CCOC(=O)C(C#N)C1(C2=C(C(=CC=C2)C)C(=O)N1C)C#N

InChI

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