N,N-diethyl-4-methyl-3-piperazin-4-ium-1-yl-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-methyl-3-piperazin-4-ium-1-yl-benzenesulfonamide Openeye Name: N,N-diethyl-4-methyl-3-piperazin-4-ium-1-yl-benzenesulfonamide CAS Name: N,N-diethyl-4-methyl-3-(1-piperazin-4-iumyl)benzenesulfonamide IUPAC Name: N,N-diethyl-4-methyl-3-piperazin-4-ium-1-ylbenzenesulfonamide Traditional Name: N,N-diethyl-4-methyl-3-piperazin-4-ium-1-yl-benzenesulfonamide Formula: C15H26N3O2S+ MolecularWeight: 312.45084

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)N2CC[NH2+]CC2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)N2CC[NH2+]CC2

InChI

InChI=1S/C15H25N3O2S/c1-4-18(5-2)21(19,20)14-7-6-13(3)15(12-14)17-10-8-16-9-11-17/h6-7,12,16H,4-5,8-11H2,1-3H3/p+1