5-fluoranyl-2-(4-methylpiperazin-4-ium-1-yl)sulfonyl-aniline

Systemtic Name: 5-fluoranyl-2-(4-methylpiperazin-4-ium-1-yl)sulfonyl-aniline Openeye Name: 5-fluoro-2-(4-methylpiperazin-4-ium-1-yl)sulfonyl-aniline CAS Name: 5-fluoro-2-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]aniline IUPAC Name: 5-fluoro-2-(4-methylpiperazin-4-ium-1-yl)sulfonylaniline Traditional Name: [5-fluoro-2-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]amine Formula: C11H17FN3O2S+ MolecularWeight: 274.334983

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)F)N

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)F)N

InChI

InChI=1S/C11H16FN3O2S/c1-14-4-6-15(7-5-14)18(16,17)11-3-2-9(12)8-10(11)13/h2-3,8H,4-7,13H2,1H3/p+1