2-[(6-fluoranylquinolin-8-yl)methylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[(6-fluoranylquinolin-8-yl)methylamino]-3-methyl-butanoic acid Openeye Name: 2-[(6-fluoro-8-quinolyl)methylamino]-3-methyl-butanoic acid CAS Name: 2-[(6-fluoro-8-quinolinyl)methylamino]-3-methylbutanoic acid IUPAC Name: 2-[(6-fluoroquinolin-8-yl)methylamino]-3-methylbutanoic acid Traditional Name: 2-[(6-fluoro-8-quinolyl)methylamino]-3-methyl-butyric acid Formula: C15H17FN2O2 MolecularWeight: 276.306083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC1=C2C(=CC(=C1)F)C=CC=N2

Isomeric SMILES

CC(C)C(C(=O)O)NCC1=C2C(=CC(=C1)F)C=CC=N2

InChI

InChI=1S/C15H17FN2O2/c1-9(2)13(15(19)20)18-8-11-7-12(16)6-10-4-3-5-17-14(10)11/h3-7,9,13,18H,8H2,1-2H3,(H,19,20)