(2R)-1-[4-[4-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]sulfonylphenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2R)-1-[4-[4-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]sulfonylphenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol Openeye Name: (2R)-1-[4-[4-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]sulfonylphenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol CAS Name: (2R)-1-[4-[4-[(2R)-2-hydroxy-3-(1-pyrrolidin-1-iumyl)propoxy]phenyl]sulfonylphenoxy]-3-(1-pyrrolidin-1-iumyl)-2-propanol IUPAC Name: (2R)-1-[4-[4-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-ylpropoxy]phenyl]sulfonylphenoxy]-3-pyrrolidin-1-ium-1-ylpropan-2-ol Traditional Name: (2R)-1-[4-[4-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]sulfonylphenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol Formula: C26H38N2O6S+2 MolecularWeight: 506.65472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(COC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OCC(C[NH+]4CCCC4)O)O

Isomeric SMILES

C1CC[NH+](C1)C[C@H](COC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OC[C@@H](C[NH+]4CCCC4)O)O

InChI

InChI=1S/C26H36N2O6S/c29-21(17-27-13-1-2-14-27)19-33-23-5-9-25(10-6-23)35(31,32)26-11-7-24(8-12-26)34-20-22(30)18-28-15-3-4-16-28/h5-12,21-22,29-30H,1-4,13-20H2/p+2/t21-,22-/m1/s1