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

Systemtic Name: 2-(1-oxidanylidene-2-propyl-isoquinolin-5-yl)oxypropanoic acid Openeye Name: 2-[(1-oxo-2-propyl-5-isoquinolyl)oxy]propanoic acid CAS Name: 2-[(1-oxo-2-propyl-5-isoquinolinyl)oxy]propanoic acid IUPAC Name: 2-(1-oxo-2-propylisoquinolin-5-yl)oxypropanoic acid Traditional Name: 2-[(1-keto-2-propyl-5-isoquinolyl)oxy]propionic acid Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CC2=C(C1=O)C=CC=C2OC(C)C(=O)O

Isomeric SMILES

CCCN1C=CC2=C(C1=O)C=CC=C2OC(C)C(=O)O

InChI

InChI=1S/C15H17NO4/c1-3-8-16-9-7-11-12(14(16)17)5-4-6-13(11)20-10(2)15(18)19/h4-7,9-10H,3,8H2,1-2H3,(H,18,19)