4-isoquinolin-1-ylbutanoic acid

Systemtic Name: 4-isoquinolin-1-ylbutanoic acid Openeye Name: 4-(1-isoquinolyl)butanoic acid CAS Name: 4-(1-isoquinolinyl)butanoic acid IUPAC Name: 4-isoquinolin-1-ylbutanoic acid Traditional Name: 4-(1-isoquinolyl)butyric acid Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2CCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2CCCC(=O)O

InChI

InChI=1S/C13H13NO2/c15-13(16)7-3-6-12-11-5-2-1-4-10(11)8-9-14-12/h1-2,4-5,8-9H,3,6-7H2,(H,15,16)