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

Systemtic Name: 1-[4-[(2R)-3-(4-morpholin-4-ylsulfonylphenoxy)-2-oxidanyl-propyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[(2R)-2-hydroxy-3-(4-morpholinosulfonylphenoxy)propyl]piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-[(2R)-2-hydroxy-3-[4-(4-morpholinylsulfonyl)phenoxy]propyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-[(2R)-2-hydroxy-3-(4-morpholin-4-ylsulfonylphenoxy)propyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-[(2R)-2-hydroxy-3-(4-morpholinosulfonylphenoxy)propyl]piperazin-4-ium-1-yl]ethanone Formula: C19H30N3O6S+ MolecularWeight: 428.523

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(COC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)O

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)C[C@H](COC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)O

InChI

InChI=1S/C19H29N3O6S/c1-16(23)21-8-6-20(7-9-21)14-17(24)15-28-18-2-4-19(5-3-18)29(25,26)22-10-12-27-13-11-22/h2-5,17,24H,6-15H2,1H3/p+1/t17-/m1/s1