N-[2-[1-[[1-(4-methoxyphenyl)imidazol-2-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]ethanamide

Systemtic Name: N-[2-[1-[[1-(4-methoxyphenyl)imidazol-2-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]ethanamide Openeye Name: N-[2-[1-[[1-(4-methoxyphenyl)imidazol-2-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]acetamide CAS Name: N-[2-[1-[[1-(4-methoxyphenyl)-2-imidazolyl]methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]acetamide IUPAC Name: N-[2-[1-[[1-(4-methoxyphenyl)imidazol-2-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]acetamide Traditional Name: N-[2-[1-[[1-(4-methoxyphenyl)imidazol-2-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]acetamide Formula: C21H27N6O2+ MolecularWeight: 395.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=NN1C2CC[NH+](CC2)CC3=NC=CN3C4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)NC1=CC=NN1C2CC[NH+](CC2)CC3=NC=CN3C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H26N6O2/c1-16(28)24-20-7-10-23-27(20)18-8-12-25(13-9-18)15-21-22-11-14-26(21)17-3-5-19(29-2)6-4-17/h3-7,10-11,14,18H,8-9,12-13,15H2,1-2H3,(H,24,28)/p+1