N-[2-[4-(2,5-diethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-2,5-diethyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(2,5-diethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-2,5-diethyl-benzenesulfonamide Openeye Name: N-[2-[4-(2,5-diethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-2,5-diethyl-benzenesulfonamide CAS Name: N-[2-[4-(2,5-diethylphenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]-2,5-diethylbenzenesulfonamide IUPAC Name: N-[2-[4-(2,5-diethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-2,5-diethylbenzenesulfonamide Traditional Name: N-[2-[4-(2,5-diethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-2,5-diethyl-benzenesulfonamide Formula: C26H40N3O4S2+ MolecularWeight: 522.7435

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)S(=O)(=O)NCC[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)CC)CC

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)S(=O)(=O)NCC[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)CC)CC

InChI

InChI=1S/C26H39N3O4S2/c1-5-21-9-11-23(7-3)25(19-21)34(30,31)27-13-14-28-15-17-29(18-16-28)35(32,33)26-20-22(6-2)10-12-24(26)8-4/h9-12,19-20,27H,5-8,13-18H2,1-4H3/p+1