1-(3,4-dichlorophenyl)sulfonyl-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine

Systemtic Name: 1-(3,4-dichlorophenyl)sulfonyl-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine Openeye Name: 1-(3,4-dichlorophenyl)sulfonyl-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine CAS Name: 1-(3,4-dichlorophenyl)sulfonyl-4-[5-(trifluoromethyl)-2-pyridin-1-iumyl]piperazine IUPAC Name: 1-(3,4-dichlorophenyl)sulfonyl-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine Traditional Name: 1-(3,4-dichlorophenyl)sulfonyl-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine Formula: C16H15Cl2F3N3O2S+ MolecularWeight: 441.27541

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=[NH+]C=C(C=C2)C(F)(F)F)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=[NH+]C=C(C=C2)C(F)(F)F)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H14Cl2F3N3O2S/c17-13-3-2-12(9-14(13)18)27(25,26)24-7-5-23(6-8-24)15-4-1-11(10-22-15)16(19,20)21/h1-4,9-10H,5-8H2/p+1