2-(1-chloranyl-7-methoxy-isoquinolin-4-yl)propanoic acid

Systemtic Name: 2-(1-chloranyl-7-methoxy-isoquinolin-4-yl)propanoic acid Openeye Name: 2-(1-chloro-7-methoxy-4-isoquinolyl)propanoic acid CAS Name: 2-(1-chloro-7-methoxy-4-isoquinolinyl)propanoic acid IUPAC Name: 2-(1-chloro-7-methoxyisoquinolin-4-yl)propanoic acid Traditional Name: 2-(1-chloro-7-methoxy-4-isoquinolyl)propionic acid Formula: C13H12ClNO3 MolecularWeight: 265.69228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=C(C2=C1C=CC(=C2)OC)Cl)C(=O)O

Isomeric SMILES

CC(C1=CN=C(C2=C1C=CC(=C2)OC)Cl)C(=O)O

InChI

InChI=1S/C13H12ClNO3/c1-7(13(16)17)11-6-15-12(14)10-5-8(18-2)3-4-9(10)11/h3-7H,1-2H3,(H,16,17)