2-[2-ethenyl-4-[4-(2-fluoranylethoxy)phenyl]sulfonyl-1-oxidanidyl-pyridin-1-ium-3-yl]aniline

Systemtic Name: 2-[2-ethenyl-4-[4-(2-fluoranylethoxy)phenyl]sulfonyl-1-oxidanidyl-pyridin-1-ium-3-yl]aniline Openeye Name: 2-[4-[4-(2-fluoroethoxy)phenyl]sulfonyl-1-oxido-2-vinyl-pyridin-1-ium-3-yl]aniline CAS Name: 2-[2-ethenyl-4-[4-(2-fluoroethoxy)phenyl]sulfonyl-1-oxido-3-pyridin-1-iumyl]aniline IUPAC Name: 2-[2-ethenyl-4-[4-(2-fluoroethoxy)phenyl]sulfonyl-1-oxidopyridin-1-ium-3-yl]aniline Traditional Name: [2-[4-[4-(2-fluoroethoxy)phenyl]sulfonyl-1-oxido-2-vinyl-pyridin-1-ium-3-yl]phenyl]amine Formula: C21H19FN2O4S MolecularWeight: 414.449963

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=[N+](C=CC(=C1C2=CC=CC=C2N)S(=O)(=O)C3=CC=C(C=C3)OCCF)[O-]

Isomeric SMILES

C=CC1=[N+](C=CC(=C1C2=CC=CC=C2N)S(=O)(=O)C3=CC=C(C=C3)OCCF)[O-]

InChI

InChI=1S/C21H19FN2O4S/c1-2-19-21(17-5-3-4-6-18(17)23)20(11-13-24(19)25)29(26,27)16-9-7-15(8-10-16)28-14-12-22/h2-11,13H,1,12,14,23H2