2-isoquinolin-5-yl-2-methyl-propanoic acid

Systemtic Name: 2-isoquinolin-5-yl-2-methyl-propanoic acid Openeye Name: 2-(5-isoquinolyl)-2-methyl-propanoic acid CAS Name: 2-(5-isoquinolinyl)-2-methylpropanoic acid IUPAC Name: 2-isoquinolin-5-yl-2-methylpropanoic acid Traditional Name: 2-(5-isoquinolyl)-2-methyl-propionic acid Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC2=C1C=CN=C2)C(=O)O

Isomeric SMILES

CC(C)(C1=CC=CC2=C1C=CN=C2)C(=O)O

InChI

InChI=1S/C13H13NO2/c1-13(2,12(15)16)11-5-3-4-9-8-14-7-6-10(9)11/h3-8H,1-2H3,(H,15,16)