3-isoquinolin-1-yl-4-phenyl-benzoic acid

Systemtic Name: 3-isoquinolin-1-yl-4-phenyl-benzoic acid Openeye Name: 3-(1-isoquinolyl)-4-phenyl-benzoic acid CAS Name: 3-(1-isoquinolinyl)-4-phenylbenzoic acid IUPAC Name: 3-isoquinolin-1-yl-4-phenylbenzoic acid Traditional Name: 3-(1-isoquinolyl)-4-phenyl-benzoic acid Formula: C22H15NO2 MolecularWeight: 325.36

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)O)C3=NC=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)O)C3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C22H15NO2/c24-22(25)17-10-11-18(15-6-2-1-3-7-15)20(14-17)21-19-9-5-4-8-16(19)12-13-23-21/h1-14H,(H,24,25)