2-(1-oxidanylidene-2-propyl-isoquinolin-5-yl)oxyhexanoic acid

Systemtic Name: 2-(1-oxidanylidene-2-propyl-isoquinolin-5-yl)oxyhexanoic acid Openeye Name: 2-[(1-oxo-2-propyl-5-isoquinolyl)oxy]hexanoic acid CAS Name: 2-[(1-oxo-2-propyl-5-isoquinolinyl)oxy]hexanoic acid IUPAC Name: 2-(1-oxo-2-propylisoquinolin-5-yl)oxyhexanoic acid Traditional Name: 2-[(1-keto-2-propyl-5-isoquinolyl)oxy]hexanoic acid Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO4/c1-3-5-8-16(18(21)22)23-15-9-6-7-14-13(15)10-12-19(11-4-2)17(14)20/h6-7,9-10,12,16H,3-5,8,11H2,1-2H3,(H,21,22)