ethyl 2-cyano-2-(1-cyano-5-methoxy-2-methyl-3-oxidanylidene-isoindol-1-yl)ethanoate

Systemtic Name: ethyl 2-cyano-2-(1-cyano-5-methoxy-2-methyl-3-oxidanylidene-isoindol-1-yl)ethanoate Openeye Name: ethyl 2-cyano-2-(1-cyano-5-methoxy-2-methyl-3-oxo-isoindolin-1-yl)acetate CAS Name: 2-cyano-2-(1-cyano-5-methoxy-2-methyl-3-oxo-1-isoindolyl)acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(1-cyano-5-methoxy-2-methyl-3-oxoisoindol-1-yl)acetate Traditional Name: 2-cyano-2-(1-cyano-3-keto-5-methoxy-2-methyl-isoindolin-1-yl)acetic acid ethyl ester Formula: C16H15N3O4 MolecularWeight: 313.308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O4/c1-4-23-15(21)13(8-17)16(9-18)12-6-5-10(22-3)7-11(12)14(20)19(16)2/h5-7,13H,4H2,1-3H3