2-(6-methoxy-7-oxidanyl-isoquinolin-4-yl)ethanoic acid

Systemtic Name: 2-(6-methoxy-7-oxidanyl-isoquinolin-4-yl)ethanoic acid Openeye Name: 2-(7-hydroxy-6-methoxy-4-isoquinolyl)acetic acid CAS Name: 2-(7-hydroxy-6-methoxy-4-isoquinolinyl)acetic acid IUPAC Name: 2-(7-hydroxy-6-methoxyisoquinolin-4-yl)acetic acid Traditional Name: 2-(7-hydroxy-6-methoxy-4-isoquinolyl)acetic acid Formula: C12H11NO4 MolecularWeight: 233.22004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=NC=C(C2=C1)CC(=O)O)O

Isomeric SMILES

COC1=C(C=C2C=NC=C(C2=C1)CC(=O)O)O

InChI

InChI=1S/C12H11NO4/c1-17-11-4-9-7(2-10(11)14)5-13-6-8(9)3-12(15)16/h2,4-6,14H,3H2,1H3,(H,15,16)