2-isoquinolin-1-ylethanoic acid

Systemtic Name: 2-isoquinolin-1-ylethanoic acid Openeye Name: 2-(1-isoquinolyl)acetic acid CAS Name: 2-(1-isoquinolinyl)acetic acid IUPAC Name: 2-isoquinolin-1-ylacetic acid Traditional Name: 2-(1-isoquinolyl)acetic acid Formula: C11H9NO2 MolecularWeight: 187.19466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2CC(=O)O

InChI

InChI=1S/C11H9NO2/c13-11(14)7-10-9-4-2-1-3-8(9)5-6-12-10/h1-6H,7H2,(H,13,14)