[(1S)-2-[(7-fluoranyl-2-methyl-quinolin-3-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(7-fluoranyl-2-methyl-quinolin-3-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(7-fluoro-2-methyl-quinoline-3-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(7-fluoro-2-methyl-3-quinolinyl)-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(7-fluoro-2-methylquinoline-3-carbonyl)amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(7-fluoro-2-methyl-quinoline-3-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C21H23FN3O+ MolecularWeight: 352.425223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)NCC(C3=CC=CC=C3)[NH+](C)C

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)NC[C@H](C3=CC=CC=C3)[NH+](C)C

InChI

InChI=1S/C21H22FN3O/c1-14-18(11-16-9-10-17(22)12-19(16)24-14)21(26)23-13-20(25(2)3)15-7-5-4-6-8-15/h4-12,20H,13H2,1-3H3,(H,23,26)/p+1/t20-/m1/s1