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

Systemtic Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,5-dimethyl-1H-pyrazole-4-carboxamide Openeye Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,5-dimethyl-1H-pyrazole-4-carboxamide CAS Name: N-[[1-[2-(2-methoxyphenyl)ethyl]-4-piperidin-1-iumyl]methyl]-N,5-dimethyl-1H-pyrazole-4-carboxamide IUPAC Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,5-dimethyl-1H-pyrazole-4-carboxamide Traditional Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,5-dimethyl-1H-pyrazole-4-carboxamide Formula: C21H31N4O2+ MolecularWeight: 371.49644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1)C(=O)N(C)CC2CC[NH+](CC2)CCC3=CC=CC=C3OC

Isomeric SMILES

CC1=C(C=NN1)C(=O)N(C)CC2CC[NH+](CC2)CCC3=CC=CC=C3OC

InChI

InChI=1S/C21H30N4O2/c1-16-19(14-22-23-16)21(26)24(2)15-17-8-11-25(12-9-17)13-10-18-6-4-5-7-20(18)27-3/h4-7,14,17H,8-13,15H2,1-3H3,(H,22,23)/p+1