[1-[1-(7-fluoranyl-4-methyl-quinolin-1-ium-2-yl)piperidin-4-yl]-1,2,3-triazol-4-yl]methyl-methyl-azanium

Systemtic Name: [1-[1-(7-fluoranyl-4-methyl-quinolin-1-ium-2-yl)piperidin-4-yl]-1,2,3-triazol-4-yl]methyl-methyl-azanium Openeye Name: [1-[1-(7-fluoro-4-methyl-quinolin-1-ium-2-yl)-4-piperidyl]triazol-4-yl]methyl-methyl-ammonium CAS Name: [1-[1-(7-fluoro-4-methyl-2-quinolin-1-iumyl)-4-piperidinyl]-4-triazolyl]methyl-methylammonium IUPAC Name: [1-[1-(7-fluoro-4-methylquinolin-1-ium-2-yl)piperidin-4-yl]triazol-4-yl]methyl-methylazanium Traditional Name: [1-[1-(7-fluoro-4-methyl-quinolin-1-ium-2-yl)-4-piperidyl]triazol-4-yl]methyl-methyl-ammonium Formula: C19H25FN6+2 MolecularWeight: 356.440403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C1C=CC(=C2)F)N3CCC(CC3)N4C=C(N=N4)C[NH2+]C

Isomeric SMILES

CC1=CC(=[NH+]C2=C1C=CC(=C2)F)N3CCC(CC3)N4C=C(N=N4)C[NH2+]C

InChI

InChI=1S/C19H23FN6/c1-13-9-19(22-18-10-14(20)3-4-17(13)18)25-7-5-16(6-8-25)26-12-15(11-21-2)23-24-26/h3-4,9-10,12,16,21H,5-8,11H2,1-2H3/p+2