ethyl 3-cyano-2-ethanoyl-1,4-dihydroisoquinoline-3-carboxylate

Systemtic Name: ethyl 3-cyano-2-ethanoyl-1,4-dihydroisoquinoline-3-carboxylate Openeye Name: ethyl 2-acetyl-3-cyano-1,4-dihydroisoquinoline-3-carboxylate CAS Name: 2-acetyl-3-cyano-1,4-dihydroisoquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-acetyl-3-cyano-1,4-dihydroisoquinoline-3-carboxylate Traditional Name: 2-acetyl-3-cyano-1,4-dihydroisoquinoline-3-carboxylic acid ethyl ester Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC2=CC=CC=C2CN1C(=O)C)C#N

Isomeric SMILES

CCOC(=O)C1(CC2=CC=CC=C2CN1C(=O)C)C#N

InChI

InChI=1S/C15H16N2O3/c1-3-20-14(19)15(10-16)8-12-6-4-5-7-13(12)9-17(15)11(2)18/h4-7H,3,8-9H2,1-2H3