1-(6-chloranylpyridin-3-yl)sulfonyl-4-[(2-fluorophenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(6-chloranylpyridin-3-yl)sulfonyl-4-[(2-fluorophenyl)methyl]piperazin-4-ium Openeye Name: 1-[(6-chloro-3-pyridyl)sulfonyl]-4-[(2-fluorophenyl)methyl]piperazin-4-ium CAS Name: 1-[(6-chloro-3-pyridinyl)sulfonyl]-4-[(2-fluorophenyl)methyl]piperazin-4-ium IUPAC Name: 1-(6-chloropyridin-3-yl)sulfonyl-4-[(2-fluorophenyl)methyl]piperazin-4-ium Traditional Name: 1-[(6-chloro-3-pyridyl)sulfonyl]-4-(2-fluorobenzyl)piperazin-4-ium Formula: C16H18ClFN3O2S+ MolecularWeight: 370.849423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2F)S(=O)(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2F)S(=O)(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C16H17ClFN3O2S/c17-16-6-5-14(11-19-16)24(22,23)21-9-7-20(8-10-21)12-13-3-1-2-4-15(13)18/h1-6,11H,7-10,12H2/p+1