1-(4-chlorophenyl)sulfonyl-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine Openeye Name: 1-(4-chlorophenyl)sulfonyl-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine CAS Name: 1-(4-chlorophenyl)sulfonyl-4-[3-(trifluoromethyl)-2-pyridin-1-iumyl]piperazine IUPAC Name: 1-(4-chlorophenyl)sulfonyl-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine Traditional Name: 1-(4-chlorophenyl)sulfonyl-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine Formula: C16H16ClF3N3O2S+ MolecularWeight: 406.83035

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=[NH+]2)C(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=[NH+]2)C(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H15ClF3N3O2S/c17-12-3-5-13(6-4-12)26(24,25)23-10-8-22(9-11-23)15-14(16(18,19)20)2-1-7-21-15/h1-7H,8-11H2/p+1