ethyl (1S)-1-cyano-1-phenyl-isoquinoline-2-carboxylate

Systemtic Name: ethyl (1S)-1-cyano-1-phenyl-isoquinoline-2-carboxylate Openeye Name: ethyl (1S)-1-cyano-1-phenyl-isoquinoline-2-carboxylate CAS Name: (1S)-1-cyano-1-phenyl-2-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl (1S)-1-cyano-1-phenylisoquinoline-2-carboxylate Traditional Name: (1S)-1-cyano-1-phenyl-isoquinoline-2-carboxylic acid ethyl ester Formula: C19H16N2O2 MolecularWeight: 304.34254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=CC2=CC=CC=C2C1(C#N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1C=CC2=CC=CC=C2[C@]1(C#N)C3=CC=CC=C3

InChI

InChI=1S/C19H16N2O2/c1-2-23-18(22)21-13-12-15-8-6-7-11-17(15)19(21,14-20)16-9-4-3-5-10-16/h3-13H,2H2,1H3/t19-/m0/s1