1-(4-fluorophenyl)-4-(5-piperidin-1-ylsulfonylpyridin-1-ium-2-yl)piperazine

Systemtic Name: 1-(4-fluorophenyl)-4-(5-piperidin-1-ylsulfonylpyridin-1-ium-2-yl)piperazine Openeye Name: 1-(4-fluorophenyl)-4-[5-(1-piperidylsulfonyl)pyridin-1-ium-2-yl]piperazine CAS Name: 1-(4-fluorophenyl)-4-[5-(1-piperidinylsulfonyl)-2-pyridin-1-iumyl]piperazine IUPAC Name: 1-(4-fluorophenyl)-4-(5-piperidin-1-ylsulfonylpyridin-1-ium-2-yl)piperazine Traditional Name: 1-(4-fluorophenyl)-4-(5-piperidinosulfonylpyridin-1-ium-2-yl)piperazine Formula: C20H26FN4O2S+ MolecularWeight: 405.509443

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H25FN4O2S/c21-17-4-6-18(7-5-17)23-12-14-24(15-13-23)20-9-8-19(16-22-20)28(26,27)25-10-2-1-3-11-25/h4-9,16H,1-3,10-15H2/p+1