(2R)-1-(4-tert-butylphenoxy)-3-[4-(4-methylphenyl)piperazin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2R)-1-(4-tert-butylphenoxy)-3-[4-(4-methylphenyl)piperazin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-(4-tert-butylphenoxy)-3-[4-(p-tolyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(4-tert-butylphenoxy)-3-[4-(4-methylphenyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-(4-tert-butylphenoxy)-3-[4-(4-methylphenyl)piperazin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-(4-tert-butylphenoxy)-3-[4-(p-tolyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C24H35N2O2+ MolecularWeight: 383.5469

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC[NH+](CC2)CC(COC3=CC=C(C=C3)C(C)(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)N2CC[NH+](CC2)C[C@H](COC3=CC=C(C=C3)C(C)(C)C)O

InChI

InChI=1S/C24H34N2O2/c1-19-5-9-21(10-6-19)26-15-13-25(14-16-26)17-22(27)18-28-23-11-7-20(8-12-23)24(2,3)4/h5-12,22,27H,13-18H2,1-4H3/p+1/t22-/m1/s1