4-[4-(5-ethyl-1H-pyrazol-3-yl)pyridin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one perchlorate

Systemtic Name: 4-[4-(5-ethyl-1H-pyrazol-3-yl)pyridin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one perchlorate Openeye Name: 4-[4-(5-ethyl-1H-pyrazol-3-yl)pyridin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one perchlorate CAS Name: 4-[4-(5-ethyl-1H-pyrazol-3-yl)-1-pyridin-1-iumyl]-1-(4-fluorophenyl)-1-butanone perchlorate IUPAC Name: 4-[4-(5-ethyl-1H-pyrazol-3-yl)pyridin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one perchlorate Traditional Name: 4-[4-(5-ethyl-1H-pyrazol-3-yl)pyridin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one perchlorate Formula: C20H21ClFN3O5 MolecularWeight: 437.849243

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1)C2=CC=[N+](C=C2)CCCC(=O)C3=CC=C(C=C3)F.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC1=CC(=NN1)C2=CC=[N+](C=C2)CCCC(=O)C3=CC=C(C=C3)F.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H20FN3O.ClHO4/c1-2-18-14-19(23-22-18)15-9-12-24(13-10-15)11-3-4-20(25)16-5-7-17(21)8-6-16;2-1(3,4)5/h5-10,12-14H,2-4,11H2,1H3;(H,2,3,4,5)