5-methyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide

Systemtic Name: 5-methyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Openeye Name: N-(1-isopropylpiperidin-1-ium-4-yl)-5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide CAS Name: 5-methyl-N-(1-propan-2-yl-4-piperidin-1-iumyl)-1-[3-(trifluoromethyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 5-methyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Traditional Name: N-(1-isopropylpiperidin-1-ium-4-yl)-5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Formula: C20H26F3N4O+ MolecularWeight: 395.44185

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NC3CC[NH+](CC3)C(C)C

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NC3CC[NH+](CC3)C(C)C

InChI

InChI=1S/C20H25F3N4O/c1-13(2)26-9-7-16(8-10-26)25-19(28)18-12-24-27(14(18)3)17-6-4-5-15(11-17)20(21,22)23/h4-6,11-13,16H,7-10H2,1-3H3,(H,25,28)/p+1