3-(1H-imidazol-5-yl)-2-[(4-methylquinolin-2-yl)amino]propanoic acid

Systemtic Name: 3-(1H-imidazol-5-yl)-2-[(4-methylquinolin-2-yl)amino]propanoic acid Openeye Name: 3-(1H-imidazol-5-yl)-2-[(4-methyl-2-quinolyl)amino]propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-[(4-methyl-2-quinolinyl)amino]propanoic acid IUPAC Name: 3-(1H-imidazol-5-yl)-2-[(4-methylquinolin-2-yl)amino]propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-[(4-methyl-2-quinolyl)amino]propionic acid Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)NC(CC3=CN=CN3)C(=O)O

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)NC(CC3=CN=CN3)C(=O)O

InChI

InChI=1S/C16H16N4O2/c1-10-6-15(19-13-5-3-2-4-12(10)13)20-14(16(21)22)7-11-8-17-9-18-11/h2-6,8-9,14H,7H2,1H3,(H,17,18)(H,19,20)(H,21,22)