1-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-pyridin-1-ium-2-yl-piperazine

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-pyridin-1-ium-2-yl-piperazine Openeye Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-pyridin-1-ium-2-yl-piperazine CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-4-(2-pyridin-1-iumyl)piperazine IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-pyridin-1-ium-2-ylpiperazine Traditional Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-pyridin-1-ium-2-yl-piperazine Formula: C15H16ClF3N4+2 MolecularWeight: 344.76255

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

InChI

InChI=1S/C15H14ClF3N4/c16-12-9-11(15(17,18)19)10-21-14(12)23-7-5-22(6-8-23)13-3-1-2-4-20-13/h1-4,9-10H,5-8H2/p+2