N-ethyl-6-[2-(2-fluorophenyl)ethylamino]-N-phenyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: N-ethyl-6-[2-(2-fluorophenyl)ethylamino]-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: N-ethyl-6-[2-(2-fluorophenyl)ethylamino]-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: N-ethyl-6-[2-(2-fluorophenyl)ethylamino]-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: N-ethyl-6-[2-(2-fluorophenyl)ethylamino]-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: N-ethyl-6-[2-(2-fluorophenyl)ethylamino]-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C21H23FN3O2S+ MolecularWeight: 400.489623

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCCC3=CC=CC=C3F

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCCC3=CC=CC=C3F

InChI

InChI=1S/C21H22FN3O2S/c1-2-25(18-9-4-3-5-10-18)28(26,27)19-12-13-21(24-16-19)23-15-14-17-8-6-7-11-20(17)22/h3-13,16H,2,14-15H2,1H3,(H,23,24)/p+1