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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)C#N)NCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)C#N)NCCC(=O)O

InChI

InChI=1S/C13H11N3O2/c14-7-9-8-16-11-4-2-1-3-10(11)13(9)15-6-5-12(17)18/h1-4,8H,5-6H2,(H,15,16)(H,17,18)