(1-oxidanidylpyridin-1-ium-2-yl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: (1-oxidanidylpyridin-1-ium-2-yl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (1-oxidopyridin-1-ium-2-yl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone CAS Name: (1-oxido-2-pyridin-1-iumyl)-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (1-oxidopyridin-1-ium-2-yl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: (1-oxidopyridin-1-ium-2-yl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]methanone Formula: C17H16F3N3O4S MolecularWeight: 415.38685

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=[N+]2[O-])S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=[N+]2[O-])S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H16F3N3O4S/c18-17(19,20)13-4-6-14(7-5-13)28(26,27)22-11-9-21(10-12-22)16(24)15-3-1-2-8-23(15)25/h1-8H,9-12H2