1-(4-fluorophenyl)-3,5-dimethyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyrazole-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-3,5-dimethyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyrazole-4-carboxamide Openeye Name: 1-(4-fluorophenyl)-3,5-dimethyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyrazole-4-carboxamide CAS Name: 1-(4-fluorophenyl)-3,5-dimethyl-N-[[2-(1-pyrrolidinyl)-4-pyridin-1-iumyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 1-(4-fluorophenyl)-3,5-dimethyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyrazole-4-carboxamide Traditional Name: 1-(4-fluorophenyl)-3,5-dimethyl-N-[(2-pyrrolidinopyridin-1-ium-4-yl)methyl]pyrazole-4-carboxamide Formula: C22H25FN5O+ MolecularWeight: 394.465203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)C(=O)NCC3=CC(=[NH+]C=C3)N4CCCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)C(=O)NCC3=CC(=[NH+]C=C3)N4CCCC4

InChI

InChI=1S/C22H24FN5O/c1-15-21(16(2)28(26-15)19-7-5-18(23)6-8-19)22(29)25-14-17-9-10-24-20(13-17)27-11-3-4-12-27/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,25,29)/p+1