N-[(4-fluorophenyl)methyl]-5-piperidin-1-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-[(4-fluorophenyl)methyl]-5-piperidin-1-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-[(4-fluorophenyl)methyl]-5-(1-piperidylsulfonyl)pyridin-1-ium-2-amine CAS Name: N-[(4-fluorophenyl)methyl]-5-(1-piperidinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-[(4-fluorophenyl)methyl]-5-piperidin-1-ylsulfonylpyridin-1-ium-2-amine Traditional Name: (4-fluorobenzyl)-(5-piperidinosulfonylpyridin-1-ium-2-yl)amine Formula: C17H21FN3O2S+ MolecularWeight: 350.430943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C17H20FN3O2S/c18-15-6-4-14(5-7-15)12-19-17-9-8-16(13-20-17)24(22,23)21-10-2-1-3-11-21/h4-9,13H,1-3,10-12H2,(H,19,20)/p+1