2-[4-[(2R)-3-(4-morpholin-4-ylsulfonylphenoxy)-2-oxidanyl-propyl]piperazin-4-ium-1-yl]phenol

Systemtic Name: 2-[4-[(2R)-3-(4-morpholin-4-ylsulfonylphenoxy)-2-oxidanyl-propyl]piperazin-4-ium-1-yl]phenol Openeye Name: 2-[4-[(2R)-2-hydroxy-3-(4-morpholinosulfonylphenoxy)propyl]piperazin-4-ium-1-yl]phenol CAS Name: 2-[4-[(2R)-2-hydroxy-3-[4-(4-morpholinylsulfonyl)phenoxy]propyl]-1-piperazin-4-iumyl]phenol IUPAC Name: 2-[4-[(2R)-2-hydroxy-3-(4-morpholin-4-ylsulfonylphenoxy)propyl]piperazin-4-ium-1-yl]phenol Traditional Name: 2-[4-[(2R)-2-hydroxy-3-(4-morpholinosulfonylphenoxy)propyl]piperazin-4-ium-1-yl]phenol Formula: C23H32N3O6S+ MolecularWeight: 478.58168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(COC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)O)C4=CC=CC=C4O

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](COC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)O)C4=CC=CC=C4O

InChI

InChI=1S/C23H31N3O6S/c27-19(17-24-9-11-25(12-10-24)22-3-1-2-4-23(22)28)18-32-20-5-7-21(8-6-20)33(29,30)26-13-15-31-16-14-26/h1-8,19,27-28H,9-18H2/p+1/t19-/m1/s1