ethyl 2-isoquinolin-5-yl-2-oxidanyl-ethanoate

Systemtic Name: ethyl 2-isoquinolin-5-yl-2-oxidanyl-ethanoate Openeye Name: ethyl 2-hydroxy-2-(5-isoquinolyl)acetate CAS Name: 2-hydroxy-2-(5-isoquinolinyl)acetic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-2-isoquinolin-5-ylacetate Traditional Name: 2-hydroxy-2-(5-isoquinolyl)acetic acid ethyl ester Formula: C13H13NO3 MolecularWeight: 231.24722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC2=C1C=CN=C2)O

Isomeric SMILES

CCOC(=O)C(C1=CC=CC2=C1C=CN=C2)O

InChI

InChI=1S/C13H13NO3/c1-2-17-13(16)12(15)11-5-3-4-9-8-14-7-6-10(9)11/h3-8,12,15H,2H2,1H3