2-(1-oxidanylideneisoquinolin-2-yl)ethanoic acid

Systemtic Name: 2-(1-oxidanylideneisoquinolin-2-yl)ethanoic acid Openeye Name: 2-(1-oxo-2-isoquinolyl)acetic acid CAS Name: 2-(1-oxo-2-isoquinolinyl)acetic acid IUPAC Name: 2-(1-oxoisoquinolin-2-yl)acetic acid Traditional Name: 2-(1-keto-2-isoquinolyl)acetic acid Formula: C11H9NO3 MolecularWeight: 203.19406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN(C2=O)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CN(C2=O)CC(=O)O

InChI

InChI=1S/C11H9NO3/c13-10(14)7-12-6-5-8-3-1-2-4-9(8)11(12)15/h1-6H,7H2,(H,13,14)