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

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-(3-nitropyridin-1-ium-2-yl)piperazine Openeye Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-(3-nitropyridin-1-ium-2-yl)piperazine CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-4-(3-nitro-2-pyridin-1-iumyl)piperazine IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-(3-nitropyridin-1-ium-2-yl)piperazine Traditional Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-(3-nitropyridin-1-ium-2-yl)piperazine Formula: C15H15ClF3N5O2+2 MolecularWeight: 389.76011

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13ClF3N5O2/c16-11-8-10(15(17,18)19)9-21-13(11)22-4-6-23(7-5-22)14-12(24(25)26)2-1-3-20-14/h1-3,8-9H,4-7H2/p+2