N-(4-azanyl-3-methoxy-phenyl)-3-(1,4-dimethylpiperazin-1-ium-1-yl)-N-oxidanyl-propane-1-sulfonamide chloride

Systemtic Name: N-(4-azanyl-3-methoxy-phenyl)-3-(1,4-dimethylpiperazin-1-ium-1-yl)-N-oxidanyl-propane-1-sulfonamide chloride Openeye Name: N-(4-amino-3-methoxy-phenyl)-3-(1,4-dimethylpiperazin-1-ium-1-yl)-N-hydroxy-propane-1-sulfonamide chloride CAS Name: N-(4-amino-3-methoxyphenyl)-3-(1,4-dimethyl-1-piperazin-1-iumyl)-N-hydroxy-1-propanesulfonamide chloride IUPAC Name: N-(4-amino-3-methoxyphenyl)-3-(1,4-dimethylpiperazin-1-ium-1-yl)-N-hydroxypropane-1-sulfonamide chloride Traditional Name: N-(4-amino-3-methoxy-phenyl)-3-(1,4-dimethylpiperazin-1-ium-1-yl)-N-hydroxy-propane-1-sulfonamide chloride Formula: C16H29ClN4O4S MolecularWeight: 408.94386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H29N4O4S.ClH/c1-18-7-10-20(2,11-8-18)9-4-12-25(22,23)19(21)14-5-6-15(17)16(13-14)24-3;/h5-6,13,21H,4,7-12,17H2,1-3H3;1H/q+1;/p-1