N-(1-ethylpiperidin-1-ium-4-yl)-5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide

Systemtic Name: N-(1-ethylpiperidin-1-ium-4-yl)-5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Openeye Name: N-(1-ethylpiperidin-1-ium-4-yl)-5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide CAS Name: N-(1-ethyl-4-piperidin-1-iumyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: N-(1-ethylpiperidin-1-ium-4-yl)-5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Traditional Name: N-(1-ethylpiperidin-1-ium-4-yl)-5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Formula: C19H24F3N4O+ MolecularWeight: 381.41527

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C(F)(F)F)C

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C(F)(F)F)C

InChI

InChI=1S/C19H23F3N4O/c1-3-25-9-7-15(8-10-25)24-18(27)17-12-23-26(13(17)2)16-6-4-5-14(11-16)19(20,21)22/h4-6,11-12,15H,3,7-10H2,1-2H3,(H,24,27)/p+1