2-(2-ethyl-1-oxidanylidene-isoquinolin-5-yl)oxypropanoic acid

Systemtic Name: 2-(2-ethyl-1-oxidanylidene-isoquinolin-5-yl)oxypropanoic acid Openeye Name: 2-[(2-ethyl-1-oxo-5-isoquinolyl)oxy]propanoic acid CAS Name: 2-[(2-ethyl-1-oxo-5-isoquinolinyl)oxy]propanoic acid IUPAC Name: 2-(2-ethyl-1-oxoisoquinolin-5-yl)oxypropanoic acid Traditional Name: 2-[(2-ethyl-1-keto-5-isoquinolyl)oxy]propionic acid Formula: C14H15NO4 MolecularWeight: 261.2732

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC2=C(C1=O)C=CC=C2OC(C)C(=O)O

Isomeric SMILES

CCN1C=CC2=C(C1=O)C=CC=C2OC(C)C(=O)O

InChI

InChI=1S/C14H15NO4/c1-3-15-8-7-10-11(13(15)16)5-4-6-12(10)19-9(2)14(17)18/h4-9H,3H2,1-2H3,(H,17,18)