3-(3,5-dimethylpyrazol-1-yl)propyl-[[7-fluoranyl-2-oxidanylidene-1-(pyridin-4-ylmethyl)quinolin-3-yl]methyl]azanium

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[[7-fluoranyl-2-oxidanylidene-1-(pyridin-4-ylmethyl)quinolin-3-yl]methyl]azanium Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[[7-fluoro-2-oxo-1-(4-pyridylmethyl)-3-quinolyl]methyl]ammonium CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)propyl-[[7-fluoro-2-oxo-1-(pyridin-4-ylmethyl)-3-quinolinyl]methyl]ammonium IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[[7-fluoro-2-oxo-1-(pyridin-4-ylmethyl)quinolin-3-yl]methyl]azanium Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[[7-fluoro-2-keto-1-(4-pyridylmethyl)-3-quinolyl]methyl]ammonium Formula: C24H27FN5O+ MolecularWeight: 420.502483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC[NH2+]CC2=CC3=C(C=C(C=C3)F)N(C2=O)CC4=CC=NC=C4)C

Isomeric SMILES

CC1=CC(=NN1CCC[NH2+]CC2=CC3=C(C=C(C=C3)F)N(C2=O)CC4=CC=NC=C4)C

InChI

InChI=1S/C24H26FN5O/c1-17-12-18(2)30(28-17)11-3-8-27-15-21-13-20-4-5-22(25)14-23(20)29(24(21)31)16-19-6-9-26-10-7-19/h4-7,9-10,12-14,27H,3,8,11,15-16H2,1-2H3/p+1