2,4,6-triethylbenzenesulfonamide; 1-(3,4,5-trimethoxyphenyl)-1-undecyl-piperazin-1-ium

Systemtic Name: 2,4,6-triethylbenzenesulfonamide; 1-(3,4,5-trimethoxyphenyl)-1-undecyl-piperazin-1-ium Openeye Name: 2,4,6-triethylbenzenesulfonamide; 1-(3,4,5-trimethoxyphenyl)-1-undecyl-piperazin-1-ium CAS Name: 2,4,6-triethylbenzenesulfonamide; 1-(3,4,5-trimethoxyphenyl)-1-undecylpiperazin-1-ium IUPAC Name: 2,4,6-triethylbenzenesulfonamide; 1-(3,4,5-trimethoxyphenyl)-1-undecylpiperazin-1-ium Traditional Name: 2,4,6-triethylbenzenesulfonamide; 1-(3,4,5-trimethoxyphenyl)-1-undecyl-piperazin-1-ium Formula: C36H62N3O5S+ MolecularWeight: 648.95958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC[N+]1(CCNCC1)C2=CC(=C(C(=C2)OC)OC)OC.CCC1=CC(=C(C(=C1)CC)S(=O)(=O)N)CC

Isomeric SMILES

CCCCCCCCCCC[N+]1(CCNCC1)C2=CC(=C(C(=C2)OC)OC)OC.CCC1=CC(=C(C(=C1)CC)S(=O)(=O)N)CC

InChI

InChI=1S/C24H43N2O3.C12H19NO2S/c1-5-6-7-8-9-10-11-12-13-16-26(17-14-25-15-18-26)21-19-22(27-2)24(29-4)23(20-21)28-3;1-4-9-7-10(5-2)12(16(13,14)15)11(6-3)8-9/h19-20,25H,5-18H2,1-4H3;7-8H,4-6H2,1-3H3,(H2,13,14,15)/q+1;