(2R)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-3-[(2-methylpropan-2-yl)oxy]propan-2-ol

Systemtic Name: (2R)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-3-[(2-methylpropan-2-yl)oxy]propan-2-ol Openeye Name: (2R)-1-tert-butoxy-3-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]-3-[(2-methylpropan-2-yl)oxy]-2-propanol IUPAC Name: (2R)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-3-[(2-methylpropan-2-yl)oxy]propan-2-ol Traditional Name: (2R)-1-tert-butoxy-3-(4-tosylpiperazin-1-ium-1-yl)propan-2-ol Formula: C18H31N2O4S+ MolecularWeight: 371.51474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(COC(C)(C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C18H30N2O4S/c1-15-5-7-17(8-6-15)25(22,23)20-11-9-19(10-12-20)13-16(21)14-24-18(2,3)4/h5-8,16,21H,9-14H2,1-4H3/p+1/t16-/m1/s1