2-[2-(2-ethoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxyhexanoic acid

Systemtic Name: 2-[2-(2-ethoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxyhexanoic acid Openeye Name: 2-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolyl]oxy]hexanoic acid CAS Name: 2-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolinyl]oxy]hexanoic acid IUPAC Name: 2-[2-(2-ethoxyethyl)-1-oxoisoquinolin-5-yl]oxyhexanoic acid Traditional Name: 2-[[2-(2-ethoxyethyl)-1-keto-5-isoquinolyl]oxy]hexanoic acid Formula: C19H25NO5 MolecularWeight: 347.4055

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)OC1=CC=CC2=C1C=CN(C2=O)CCOCC

Isomeric SMILES

CCCCC(C(=O)O)OC1=CC=CC2=C1C=CN(C2=O)CCOCC

InChI

InChI=1S/C19H25NO5/c1-3-5-8-17(19(22)23)25-16-9-6-7-15-14(16)10-11-20(18(15)21)12-13-24-4-2/h6-7,9-11,17H,3-5,8,12-13H2,1-2H3,(H,22,23)