1,3,5-trimethyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]pyrazole-4-carboxamide

Systemtic Name: 1,3,5-trimethyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]pyrazole-4-carboxamide Openeye Name: 1,3,5-trimethyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]pyrazole-4-carboxamide CAS Name: 1,3,5-trimethyl-N-[[4-[(4-methyl-1-piperidin-1-iumyl)methyl]phenyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 1,3,5-trimethyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]pyrazole-4-carboxamide Traditional Name: 1,3,5-trimethyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzyl]pyrazole-4-carboxamide Formula: C21H31N4O+ MolecularWeight: 355.49704

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=C(N(N=C3C)C)C

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=C(N(N=C3C)C)C

InChI

InChI=1S/C21H30N4O/c1-15-9-11-25(12-10-15)14-19-7-5-18(6-8-19)13-22-21(26)20-16(2)23-24(4)17(20)3/h5-8,15H,9-14H2,1-4H3,(H,22,26)/p+1