2-[(3-cyanoquinolin-4-yl)amino]propanoic acid

Systemtic Name: 2-[(3-cyanoquinolin-4-yl)amino]propanoic acid Openeye Name: 2-[(3-cyano-4-quinolyl)amino]propanoic acid CAS Name: 2-[(3-cyano-4-quinolinyl)amino]propanoic acid IUPAC Name: 2-[(3-cyanoquinolin-4-yl)amino]propanoic acid Traditional Name: 2-[(3-cyano-4-quinolyl)amino]propionic acid Formula: C13H11N3O2 MolecularWeight: 241.24534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=C(C=NC2=CC=CC=C21)C#N

Isomeric SMILES

CC(C(=O)O)NC1=C(C=NC2=CC=CC=C21)C#N

InChI

InChI=1S/C13H11N3O2/c1-8(13(17)18)16-12-9(6-14)7-15-11-5-3-2-4-10(11)12/h2-5,7-8H,1H3,(H,15,16)(H,17,18)