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

Systemtic Name: N-[2-[1-[(2R)-1-phenoxypropan-2-yl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenyl-ethanamide Openeye Name: N-[2-[1-[(1R)-1-methyl-2-phenoxy-ethyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenyl-acetamide CAS Name: N-[2-[1-[(2R)-1-phenoxypropan-2-yl]-4-piperidin-1-iumyl]-3-pyrazolyl]-2-phenylacetamide IUPAC Name: N-[2-[1-[(2R)-1-phenoxypropan-2-yl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenylacetamide Traditional Name: N-[2-[1-[(1R)-1-methyl-2-phenoxy-ethyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-phenyl-acetamide Formula: C25H31N4O2+ MolecularWeight: 419.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

C[C@H](COC1=CC=CC=C1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2/c1-20(19-31-23-10-6-3-7-11-23)28-16-13-22(14-17-28)29-24(12-15-26-29)27-25(30)18-21-8-4-2-5-9-21/h2-12,15,20,22H,13-14,16-19H2,1H3,(H,27,30)/p+1/t20-/m1/s1