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

Systemtic Name: N-[2-[1-[[3-(2-hydroxyethyloxy)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenyl-ethanamide Openeye Name: N-[2-[1-[[3-(2-hydroxyethoxy)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenyl-acetamide CAS Name: N-[2-[1-[[3-(2-hydroxyethoxy)phenyl]methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]-2-phenylacetamide IUPAC Name: N-[2-[1-[[3-(2-hydroxyethoxy)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenylacetamide Traditional Name: N-[2-[1-[3-(2-hydroxyethoxy)benzyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenyl-acetamide Formula: C25H31N4O3+ MolecularWeight: 435.53864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)CC3=CC=CC=C3)CC4=CC(=CC=C4)OCCO

Isomeric SMILES

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)CC3=CC=CC=C3)CC4=CC(=CC=C4)OCCO

InChI

InChI=1S/C25H30N4O3/c30-15-16-32-23-8-4-7-21(17-23)19-28-13-10-22(11-14-28)29-24(9-12-26-29)27-25(31)18-20-5-2-1-3-6-20/h1-9,12,17,22,30H,10-11,13-16,18-19H2,(H,27,31)/p+1