methyl (2E)-2-cyano-2-(2-methylisoquinolin-1-ylidene)ethanoate

Systemtic Name: methyl (2E)-2-cyano-2-(2-methylisoquinolin-1-ylidene)ethanoate Openeye Name: methyl (2E)-2-cyano-2-(2-methyl-1-isoquinolylidene)acetate CAS Name: (2E)-2-cyano-2-(2-methyl-1-isoquinolinylidene)acetic acid methyl ester IUPAC Name: methyl (2E)-2-cyano-2-(2-methylisoquinolin-1-ylidene)acetate Traditional Name: (2E)-2-cyano-2-(2-methyl-1-isoquinolylidene)acetic acid methyl ester Formula: C14H12N2O2 MolecularWeight: 240.25728

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=CC=CC=C2C1=C(C#N)C(=O)OC

Isomeric SMILES

CN\1C=CC2=CC=CC=C2/C1=C(/C#N)\C(=O)OC

InChI

InChI=1S/C14H12N2O2/c1-16-8-7-10-5-3-4-6-11(10)13(16)12(9-15)14(17)18-2/h3-8H,1-2H3/b13-12+