2-(1-cyclohexylisoquinolin-5-yl)propanoic acid

Systemtic Name: 2-(1-cyclohexylisoquinolin-5-yl)propanoic acid Openeye Name: 2-(1-cyclohexyl-5-isoquinolyl)propanoic acid CAS Name: 2-(1-cyclohexyl-5-isoquinolinyl)propanoic acid IUPAC Name: 2-(1-cyclohexylisoquinolin-5-yl)propanoic acid Traditional Name: 2-(1-cyclohexyl-5-isoquinolyl)propionic acid Formula: C18H21NO2 MolecularWeight: 283.36484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=C1C=CN=C2C3CCCCC3)C(=O)O

Isomeric SMILES

CC(C1=CC=CC2=C1C=CN=C2C3CCCCC3)C(=O)O

InChI

InChI=1S/C18H21NO2/c1-12(18(20)21)14-8-5-9-16-15(14)10-11-19-17(16)13-6-3-2-4-7-13/h5,8-13H,2-4,6-7H2,1H3,(H,20,21)