(2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: (2-chloro-6-fluoro-phenyl)methyl-cyclopropyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]ammonium CAS Name: (2-chloro-6-fluorophenyl)methyl-cyclopropyl-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]ammonium IUPAC Name: (2-chloro-6-fluorophenyl)methyl-cyclopropyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]azanium Traditional Name: (2-chloro-6-fluoro-benzyl)-cyclopropyl-[2-keto-2-(4-mesylpiperazino)ethyl]ammonium Formula: C17H24ClFN3O3S+ MolecularWeight: 404.907163

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)C[NH+](CC2=C(C=CC=C2Cl)F)C3CC3

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)C[NH+](CC2=C(C=CC=C2Cl)F)C3CC3

InChI

InChI=1S/C17H23ClFN3O3S/c1-26(24,25)22-9-7-20(8-10-22)17(23)12-21(13-5-6-13)11-14-15(18)3-2-4-16(14)19/h2-4,13H,5-12H2,1H3/p+1