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

Systemtic Name: (2R)-1-(diphenylmethyl)oxy-3-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-benzhydryloxy-3-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(diphenylmethyl)oxy-3-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-benzhydryloxy-3-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-benzhydryloxy-3-(4-o-phenetylpiperazin-1-ium-1-yl)propan-2-ol Formula: C28H35N2O3+ MolecularWeight: 447.5891

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(COC(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)C[C@H](COC(C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C28H34N2O3/c1-2-32-27-16-10-9-15-26(27)30-19-17-29(18-20-30)21-25(31)22-33-28(23-11-5-3-6-12-23)24-13-7-4-8-14-24/h3-16,25,28,31H,2,17-22H2,1H3/p+1/t25-/m1/s1