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

Systemtic Name: (2R)-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-[(3-methyl-1H-indol-4-yl)oxy]propan-2-ol Openeye Name: (2R)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-[(3-methyl-1H-indol-4-yl)oxy]propan-2-ol CAS Name: (2R)-1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-3-[(3-methyl-1H-indol-4-yl)oxy]-2-propanol IUPAC Name: (2R)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-[(3-methyl-1H-indol-4-yl)oxy]propan-2-ol Traditional Name: (2R)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-[(3-methyl-1H-indol-4-yl)oxy]propan-2-ol Formula: C29H34N3O2+ MolecularWeight: 456.59916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC2=C1C(=CC=C2)OCC(CN3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

CC1=CNC2=C1C(=CC=C2)OC[C@@H](CN3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C29H33N3O2/c1-22-19-30-26-13-8-14-27(28(22)26)34-21-25(33)20-31-15-17-32(18-16-31)29(23-9-4-2-5-10-23)24-11-6-3-7-12-24/h2-14,19,25,29-30,33H,15-18,20-21H2,1H3/p+1/t25-/m1/s1