N,N-dimethyl-4-[(2R)-3-naphthalen-2-yloxy-2-oxidanyl-propyl]piperazin-4-ium-1-sulfonamide

Systemtic Name: N,N-dimethyl-4-[(2R)-3-naphthalen-2-yloxy-2-oxidanyl-propyl]piperazin-4-ium-1-sulfonamide Openeye Name: 4-[(2R)-2-hydroxy-3-(2-naphthyloxy)propyl]-N,N-dimethyl-piperazin-4-ium-1-sulfonamide CAS Name: 4-[(2R)-2-hydroxy-3-(2-naphthalenyloxy)propyl]-N,N-dimethyl-1-piperazin-4-iumsulfonamide IUPAC Name: 4-[(2R)-2-hydroxy-3-naphthalen-2-yloxypropyl]-N,N-dimethylpiperazin-4-ium-1-sulfonamide Traditional Name: 4-[(2R)-2-hydroxy-3-(2-naphthoxy)propyl]-N,N-dimethyl-piperazin-4-ium-1-sulfonamide Formula: C19H28N3O4S+ MolecularWeight: 394.50832

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CC[NH+](CC1)CC(COC2=CC3=CC=CC=C3C=C2)O

Isomeric SMILES

CN(C)S(=O)(=O)N1CC[NH+](CC1)C[C@H](COC2=CC3=CC=CC=C3C=C2)O

InChI

InChI=1S/C19H27N3O4S/c1-20(2)27(24,25)22-11-9-21(10-12-22)14-18(23)15-26-19-8-7-16-5-3-4-6-17(16)13-19/h3-8,13,18,23H,9-12,14-15H2,1-2H3/p+1/t18-/m1/s1