2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N,N-dimethyl-5-nitro-benzenesulfonamide

Systemtic Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N,N-dimethyl-5-nitro-benzenesulfonamide Openeye Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N,N-dimethyl-5-nitro-benzenesulfonamide CAS Name: 2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-N,N-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N,N-dimethyl-5-nitrobenzenesulfonamide Traditional Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N,N-dimethyl-5-nitro-benzenesulfonamide Formula: C14H23N4O5S+ MolecularWeight: 359.42122

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2CC[NH+](CC2)CCO

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2CC[NH+](CC2)CCO

InChI

InChI=1S/C14H22N4O5S/c1-15(2)24(22,23)14-11-12(18(20)21)3-4-13(14)17-7-5-16(6-8-17)9-10-19/h3-4,11,19H,5-10H2,1-2H3/p+1