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

Systemtic Name: 2-[(3-cyanoquinolin-4-yl)amino]hexanoic acid Openeye Name: 2-[(3-cyano-4-quinolyl)amino]hexanoic acid CAS Name: 2-[(3-cyano-4-quinolinyl)amino]hexanoic acid IUPAC Name: 2-[(3-cyanoquinolin-4-yl)amino]hexanoic acid Traditional Name: 2-[(3-cyano-4-quinolyl)amino]hexanoic acid Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O2/c1-2-3-7-14(16(20)21)19-15-11(9-17)10-18-13-8-5-4-6-12(13)15/h4-6,8,10,14H,2-3,7H2,1H3,(H,18,19)(H,20,21)