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

Systemtic Name: 2-[(3-cyanoquinolin-4-yl)amino]ethanoic acid Openeye Name: 2-[(3-cyano-4-quinolyl)amino]acetic acid CAS Name: 2-[(3-cyano-4-quinolinyl)amino]acetic acid IUPAC Name: 2-[(3-cyanoquinolin-4-yl)amino]acetic acid Traditional Name: 2-[(3-cyano-4-quinolyl)amino]acetic acid Formula: C12H9N3O2 MolecularWeight: 227.21876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9N3O2/c13-5-8-6-14-10-4-2-1-3-9(10)12(8)15-7-11(16)17/h1-4,6H,7H2,(H,14,15)(H,16,17)