methyl 2-cyano-2-(3-oxidanylidene-1,2-dihydroisoindol-1-yl)ethanoate

Systemtic Name: methyl 2-cyano-2-(3-oxidanylidene-1,2-dihydroisoindol-1-yl)ethanoate Openeye Name: methyl 2-cyano-2-(3-oxoisoindolin-1-yl)acetate CAS Name: 2-cyano-2-(3-oxo-1,2-dihydroisoindol-1-yl)acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-(3-oxo-1,2-dihydroisoindol-1-yl)acetate Traditional Name: 2-cyano-2-(3-ketoisoindolin-1-yl)acetic acid methyl ester Formula: C12H10N2O3 MolecularWeight: 230.2194

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C1C2=CC=CC=C2C(=O)N1

Isomeric SMILES

COC(=O)C(C#N)C1C2=CC=CC=C2C(=O)N1

InChI

InChI=1S/C12H10N2O3/c1-17-12(16)9(6-13)10-7-4-2-3-5-8(7)11(15)14-10/h2-5,9-10H,1H3,(H,14,15)