2-[4-[2,5-bis(fluoranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]-N-cyclohexyl-N-methyl-ethanamide

Systemtic Name: 2-[4-[2,5-bis(fluoranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]-N-cyclohexyl-N-methyl-ethanamide Openeye Name: N-cyclohexyl-2-[4-(2,5-difluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-methyl-acetamide CAS Name: N-cyclohexyl-2-[4-(2,5-difluorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-methylacetamide IUPAC Name: N-cyclohexyl-2-[4-(2,5-difluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-methylacetamide Traditional Name: N-cyclohexyl-2-[4-(2,5-difluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-methyl-acetamide Formula: C19H28F2N3O3S+ MolecularWeight: 416.505726

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F

Isomeric SMILES

CN(C1CCCCC1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C19H27F2N3O3S/c1-22(16-5-3-2-4-6-16)19(25)14-23-9-11-24(12-10-23)28(26,27)18-13-15(20)7-8-17(18)21/h7-8,13,16H,2-6,9-12,14H2,1H3/p+1