ethyl 1-cyano-3-methyl-1H-isoquinoline-2-carboxylate

Systemtic Name: ethyl 1-cyano-3-methyl-1H-isoquinoline-2-carboxylate Openeye Name: ethyl 1-cyano-3-methyl-1H-isoquinoline-2-carboxylate CAS Name: 1-cyano-3-methyl-1H-isoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 1-cyano-3-methyl-1H-isoquinoline-2-carboxylate Traditional Name: 1-cyano-3-methyl-1H-isoquinoline-2-carboxylic acid ethyl ester Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C2=CC=CC=C2C=C1C)C#N

Isomeric SMILES

CCOC(=O)N1C(C2=CC=CC=C2C=C1C)C#N

InChI

InChI=1S/C14H14N2O2/c1-3-18-14(17)16-10(2)8-11-6-4-5-7-12(11)13(16)9-15/h4-8,13H,3H2,1-2H3