4-[(7-fluoranyl-2-methyl-quinolin-4-yl)methyl]-1,4-oxazepan-4-ium

Systemtic Name: 4-[(7-fluoranyl-2-methyl-quinolin-4-yl)methyl]-1,4-oxazepan-4-ium Openeye Name: 4-[(7-fluoro-2-methyl-4-quinolyl)methyl]-1,4-oxazepan-4-ium CAS Name: 4-[(7-fluoro-2-methyl-4-quinolinyl)methyl]-1,4-oxazepan-4-ium IUPAC Name: 4-[(7-fluoro-2-methylquinolin-4-yl)methyl]-1,4-oxazepan-4-ium Traditional Name: 4-[(7-fluoro-2-methyl-4-quinolyl)methyl]-1,4-oxazepan-4-ium Formula: C16H20FN2O+ MolecularWeight: 275.341203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)F)C(=C1)C[NH+]3CCCOCC3

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)F)C(=C1)C[NH+]3CCCOCC3

InChI

InChI=1S/C16H19FN2O/c1-12-9-13(11-19-5-2-7-20-8-6-19)15-4-3-14(17)10-16(15)18-12/h3-4,9-10H,2,5-8,11H2,1H3/p+1