3-(1,4-dimethylpiperazin-1-ium-1-yl)-N-(3-methoxyphenyl)-N-oxidanyl-propane-1-sulfonamide chloride

Systemtic Name: 3-(1,4-dimethylpiperazin-1-ium-1-yl)-N-(3-methoxyphenyl)-N-oxidanyl-propane-1-sulfonamide chloride Openeye Name: 3-(1,4-dimethylpiperazin-1-ium-1-yl)-N-hydroxy-N-(3-methoxyphenyl)propane-1-sulfonamide chloride CAS Name: 3-(1,4-dimethyl-1-piperazin-1-iumyl)-N-hydroxy-N-(3-methoxyphenyl)-1-propanesulfonamide chloride IUPAC Name: 3-(1,4-dimethylpiperazin-1-ium-1-yl)-N-hydroxy-N-(3-methoxyphenyl)propane-1-sulfonamide chloride Traditional Name: 3-(1,4-dimethylpiperazin-1-ium-1-yl)-N-hydroxy-N-(3-methoxyphenyl)propane-1-sulfonamide chloride Formula: C16H28ClN3O4S MolecularWeight: 393.92922

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](CC1)(C)CCCS(=O)(=O)N(C2=CC(=CC=C2)OC)O.[Cl-]

Isomeric SMILES

CN1CC[N+](CC1)(C)CCCS(=O)(=O)N(C2=CC(=CC=C2)OC)O.[Cl-]

InChI

InChI=1S/C16H28N3O4S.ClH/c1-17-8-11-19(2,12-9-17)10-5-13-24(21,22)18(20)15-6-4-7-16(14-15)23-3;/h4,6-7,14,20H,5,8-13H2,1-3H3;1H/q+1;/p-1