ethyl 2-[1-(4-chlorophenyl)isoquinolin-5-yl]-2-cyano-propanoate

Systemtic Name: ethyl 2-[1-(4-chlorophenyl)isoquinolin-5-yl]-2-cyano-propanoate Openeye Name: ethyl 2-[1-(4-chlorophenyl)-5-isoquinolyl]-2-cyano-propanoate CAS Name: 2-[1-(4-chlorophenyl)-5-isoquinolinyl]-2-cyanopropanoic acid ethyl ester IUPAC Name: ethyl 2-[1-(4-chlorophenyl)isoquinolin-5-yl]-2-cyanopropanoate Traditional Name: 2-[1-(4-chlorophenyl)-5-isoquinolyl]-2-cyano-propionic acid ethyl ester Formula: C21H17ClN2O2 MolecularWeight: 364.82488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C#N)C1=CC=CC2=C1C=CN=C2C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C(C)(C#N)C1=CC=CC2=C1C=CN=C2C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H17ClN2O2/c1-3-26-20(25)21(2,13-23)18-6-4-5-17-16(18)11-12-24-19(17)14-7-9-15(22)10-8-14/h4-12H,3H2,1-2H3