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

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[[7-fluoranyl-2-oxidanylidene-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl]azanium Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[[7-fluoro-2-oxo-1-(2-pyridylmethyl)-3-quinolyl]methyl]ammonium CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)ethyl-[[7-fluoro-2-oxo-1-(2-pyridinylmethyl)-3-quinolinyl]methyl]ammonium IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[[7-fluoro-2-oxo-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl]azanium Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[[7-fluoro-2-keto-1-(2-pyridylmethyl)-3-quinolyl]methyl]ammonium Formula: C23H25FN5O+ MolecularWeight: 406.475903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC[NH2+]CC2=CC3=C(C=C(C=C3)F)N(C2=O)CC4=CC=CC=N4)C

Isomeric SMILES

CC1=CC(=NN1CC[NH2+]CC2=CC3=C(C=C(C=C3)F)N(C2=O)CC4=CC=CC=N4)C

InChI

InChI=1S/C23H24FN5O/c1-16-11-17(2)29(27-16)10-9-25-14-19-12-18-6-7-20(24)13-22(18)28(23(19)30)15-21-5-3-4-8-26-21/h3-8,11-13,25H,9-10,14-15H2,1-2H3/p+1