2-(1-phenylisoquinolin-5-yl)ethanoic acid

Systemtic Name: 2-(1-phenylisoquinolin-5-yl)ethanoic acid Openeye Name: 2-(1-phenyl-5-isoquinolyl)acetic acid CAS Name: 2-(1-phenyl-5-isoquinolinyl)acetic acid IUPAC Name: 2-(1-phenylisoquinolin-5-yl)acetic acid Traditional Name: 2-(1-phenyl-5-isoquinolyl)acetic acid Formula: C17H13NO2 MolecularWeight: 263.29062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC=CC3=C2C=CC=C3CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC=CC3=C2C=CC=C3CC(=O)O

InChI

InChI=1S/C17H13NO2/c19-16(20)11-13-7-4-8-15-14(13)9-10-18-17(15)12-5-2-1-3-6-12/h1-10H,11H2,(H,19,20)