1-[1-(2-oxidanyl-3-phenoxy-propyl)piperazin-1-ium-1-yl]-3-phenoxy-propan-2-ol

Systemtic Name: 1-[1-(2-oxidanyl-3-phenoxy-propyl)piperazin-1-ium-1-yl]-3-phenoxy-propan-2-ol Openeye Name: 1-[1-(2-hydroxy-3-phenoxy-propyl)piperazin-1-ium-1-yl]-3-phenoxy-propan-2-ol CAS Name: 1-[1-(2-hydroxy-3-phenoxypropyl)-1-piperazin-1-iumyl]-3-phenoxy-2-propanol IUPAC Name: 1-[1-(2-hydroxy-3-phenoxypropyl)piperazin-1-ium-1-yl]-3-phenoxypropan-2-ol Traditional Name: 1-[1-(2-hydroxy-3-phenoxy-propyl)piperazin-1-ium-1-yl]-3-phenoxy-propan-2-ol Formula: C22H31N2O4+ MolecularWeight: 387.49254

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(CC(COC2=CC=CC=C2)O)CC(COC3=CC=CC=C3)O

Isomeric SMILES

C1C[N+](CCN1)(CC(COC2=CC=CC=C2)O)CC(COC3=CC=CC=C3)O

InChI

InChI=1S/C22H31N2O4/c25-19(17-27-21-7-3-1-4-8-21)15-24(13-11-23-12-14-24)16-20(26)18-28-22-9-5-2-6-10-22/h1-10,19-20,23,25-26H,11-18H2/q+1