2-(6-ethoxyisoquinolin-4-yl)ethanoic acid

Systemtic Name: 2-(6-ethoxyisoquinolin-4-yl)ethanoic acid Openeye Name: 2-(6-ethoxy-4-isoquinolyl)acetic acid CAS Name: 2-(6-ethoxy-4-isoquinolinyl)acetic acid IUPAC Name: 2-(6-ethoxyisoquinolin-4-yl)acetic acid Traditional Name: 2-(6-ethoxy-4-isoquinolyl)acetic acid Formula: C13H13NO3 MolecularWeight: 231.24722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=NC=C2C=C1)CC(=O)O

Isomeric SMILES

CCOC1=CC2=C(C=NC=C2C=C1)CC(=O)O

InChI

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