4-decylsulfonyl-1-[(4-fluorophenyl)methyl]-1-methyl-piperazin-1-ium

Systemtic Name: 4-decylsulfonyl-1-[(4-fluorophenyl)methyl]-1-methyl-piperazin-1-ium Openeye Name: 4-decylsulfonyl-1-[(4-fluorophenyl)methyl]-1-methyl-piperazin-1-ium CAS Name: 4-decylsulfonyl-1-[(4-fluorophenyl)methyl]-1-methylpiperazin-1-ium IUPAC Name: 4-decylsulfonyl-1-[(4-fluorophenyl)methyl]-1-methylpiperazin-1-ium Traditional Name: 4-decylsulfonyl-1-(4-fluorobenzyl)-1-methyl-piperazin-1-ium Formula: C22H38FN2O2S+ MolecularWeight: 413.612723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCS(=O)(=O)N1CC[N+](CC1)(C)CC2=CC=C(C=C2)F

Isomeric SMILES

CCCCCCCCCCS(=O)(=O)N1CC[N+](CC1)(C)CC2=CC=C(C=C2)F

InChI

InChI=1S/C22H38FN2O2S/c1-3-4-5-6-7-8-9-10-19-28(26,27)24-15-17-25(2,18-16-24)20-21-11-13-22(23)14-12-21/h11-14H,3-10,15-20H2,1-2H3/q+1