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

Systemtic Name: 2-(2-ethyl-1-oxidanylidene-isoquinolin-5-yl)oxybutanoic acid Openeye Name: 2-[(2-ethyl-1-oxo-5-isoquinolyl)oxy]butanoic acid CAS Name: 2-[(2-ethyl-1-oxo-5-isoquinolinyl)oxy]butanoic acid IUPAC Name: 2-(2-ethyl-1-oxoisoquinolin-5-yl)oxybutanoic acid Traditional Name: 2-[(2-ethyl-1-keto-5-isoquinolyl)oxy]butyric acid Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)OC1=CC=CC2=C1C=CN(C2=O)CC

Isomeric SMILES

CCC(C(=O)O)OC1=CC=CC2=C1C=CN(C2=O)CC

InChI

InChI=1S/C15H17NO4/c1-3-12(15(18)19)20-13-7-5-6-11-10(13)8-9-16(4-2)14(11)17/h5-9,12H,3-4H2,1-2H3,(H,18,19)