ethyl isoquinoline-3-carboxylate

Systemtic Name: ethyl isoquinoline-3-carboxylate Openeye Name: ethyl isoquinoline-3-carboxylate CAS Name: 3-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl isoquinoline-3-carboxylate Traditional Name: isoquinoline-3-carboxylic acid ethyl ester Formula: C12H11NO2 MolecularWeight: 201.22124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=CC=CC=C2C=N1

Isomeric SMILES

CCOC(=O)C1=CC2=CC=CC=C2C=N1

InChI

InChI=1S/C12H11NO2/c1-2-15-12(14)11-7-9-5-3-4-6-10(9)8-13-11/h3-8H,2H2,1H3