(4-ethylpiperazin-4-ium-1-yl)-(6-fluoranyl-2-methyl-quinolin-4-yl)methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-(6-fluoranyl-2-methyl-quinolin-4-yl)methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-(6-fluoro-2-methyl-4-quinolyl)methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-(6-fluoro-2-methyl-4-quinolinyl)methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-(6-fluoro-2-methylquinolin-4-yl)methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-(6-fluoro-2-methyl-4-quinolyl)methanone Formula: C17H21FN3O+ MolecularWeight: 302.366543

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)F)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)F)C

InChI

InChI=1S/C17H20FN3O/c1-3-20-6-8-21(9-7-20)17(22)15-10-12(2)19-16-5-4-13(18)11-14(15)16/h4-5,10-11H,3,6-9H2,1-2H3/p+1