(2R)-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-(2-methylbutan-2-yloxy)propan-2-ol

Systemtic Name: (2R)-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-(2-methylbutan-2-yloxy)propan-2-ol Openeye Name: (2R)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-(1,1-dimethylpropoxy)propan-2-ol CAS Name: (2R)-1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-3-(2-methylbutan-2-yloxy)-2-propanol IUPAC Name: (2R)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-(2-methylbutan-2-yloxy)propan-2-ol Traditional Name: (2R)-1-tert-amyloxy-3-(4-benzhydrylpiperazin-4-ium-1-yl)propan-2-ol Formula: C25H37N2O2+ MolecularWeight: 397.57348

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OCC(CN1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)O

Isomeric SMILES

CCC(C)(C)OC[C@@H](CN1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C25H36N2O2/c1-4-25(2,3)29-20-23(28)19-26-15-17-27(18-16-26)24(21-11-7-5-8-12-21)22-13-9-6-10-14-22/h5-14,23-24,28H,4,15-20H2,1-3H3/p+1/t23-/m1/s1