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

Systemtic Name: 4-methoxy-N-[2-[1-[(2R)-1-phenoxypropan-2-yl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: 4-methoxy-N-[2-[1-[(1R)-1-methyl-2-phenoxy-ethyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide CAS Name: 4-methoxy-N-[2-[1-[(2R)-1-phenoxypropan-2-yl]-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: 4-methoxy-N-[2-[1-[(2R)-1-phenoxypropan-2-yl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Traditional Name: 4-methoxy-N-[2-[1-[(1R)-1-methyl-2-phenoxy-ethyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Formula: C25H31N4O3+ MolecularWeight: 435.53864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N4O3/c1-19(18-32-23-6-4-3-5-7-23)28-16-13-21(14-17-28)29-24(12-15-26-29)27-25(30)20-8-10-22(31-2)11-9-20/h3-12,15,19,21H,13-14,16-18H2,1-2H3,(H,27,30)/p+1/t19-/m1/s1