4-tert-butyl-N-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[2-[4-(4-tert-butylphenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzenesulfonamide Formula: C26H40N3O4S2+ MolecularWeight: 522.7435

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H39N3O4S2/c1-25(2,3)21-7-11-23(12-8-21)34(30,31)27-15-16-28-17-19-29(20-18-28)35(32,33)24-13-9-22(10-14-24)26(4,5)6/h7-14,27H,15-20H2,1-6H3/p+1