N-[4,5-bis(4-fluorophenyl)-1-(2-hydroxyethyl)-2-methyl-piperazin-1-ium-1-yl]pentane-1-sulfonamide

Systemtic Name: N-[4,5-bis(4-fluorophenyl)-1-(2-hydroxyethyl)-2-methyl-piperazin-1-ium-1-yl]pentane-1-sulfonamide Openeye Name: N-[4,5-bis(4-fluorophenyl)-1-(2-hydroxyethyl)-2-methyl-piperazin-1-ium-1-yl]pentane-1-sulfonamide CAS Name: N-[4,5-bis(4-fluorophenyl)-1-(2-hydroxyethyl)-2-methyl-1-piperazin-1-iumyl]-1-pentanesulfonamide IUPAC Name: N-[4,5-bis(4-fluorophenyl)-1-(2-hydroxyethyl)-2-methylpiperazin-1-ium-1-yl]pentane-1-sulfonamide Traditional Name: N-[4,5-bis(4-fluorophenyl)-1-(2-hydroxyethyl)-2-methyl-piperazin-1-ium-1-yl]pentane-1-sulfonamide Formula: C24H34F2N3O3S+ MolecularWeight: 482.606866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)N[N+]1(CC(N(CC1C)C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)CCO

Isomeric SMILES

CCCCCS(=O)(=O)N[N+]1(CC(N(CC1C)C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)CCO

InChI

InChI=1S/C24H34F2N3O3S/c1-3-4-5-16-33(31,32)27-29(14-15-30)18-24(20-6-8-21(25)9-7-20)28(17-19(29)2)23-12-10-22(26)11-13-23/h6-13,19,24,27,30H,3-5,14-18H2,1-2H3/q+1