N-[[1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,5-dimethyl-1H-pyrazole-3-carboxamide

Systemtic Name: N-[[1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,5-dimethyl-1H-pyrazole-3-carboxamide Openeye Name: N-[[1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,5-dimethyl-1H-pyrazole-3-carboxamide CAS Name: N-[[1-[2-(3-fluorophenyl)ethyl]-4-piperidin-1-iumyl]methyl]-N,5-dimethyl-1H-pyrazole-3-carboxamide IUPAC Name: N-[[1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,5-dimethyl-1H-pyrazole-3-carboxamide Traditional Name: N-[[1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,5-dimethyl-1H-pyrazole-3-carboxamide Formula: C20H28FN4O+ MolecularWeight: 359.460923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)N(C)CC2CC[NH+](CC2)CCC3=CC(=CC=C3)F

Isomeric SMILES

CC1=CC(=NN1)C(=O)N(C)CC2CC[NH+](CC2)CCC3=CC(=CC=C3)F

InChI

InChI=1S/C20H27FN4O/c1-15-12-19(23-22-15)20(26)24(2)14-17-7-10-25(11-8-17)9-6-16-4-3-5-18(21)13-16/h3-5,12-13,17H,6-11,14H2,1-2H3,(H,22,23)/p+1