1-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]pyrazol-1-ium-1,5-diamine

Systemtic Name: 1-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]pyrazol-1-ium-1,5-diamine Openeye Name: 1-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]pyrazol-1-ium-1,5-diamine CAS Name: 1-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]pyrazol-1-ium-1,5-diamine IUPAC Name: 1-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]pyrazol-1-ium-1,5-diamine Traditional Name: [2-amino-2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]pyrazol-2-ium-3-yl]amine Formula: C13H9F6N6+ MolecularWeight: 363.241179

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC2=C1C(=CC(=N2)C(F)(F)F)C(F)(F)F)[N+]3(C(=CC=N3)N)N

Isomeric SMILES

C1=CC(=NC2=C1C(=CC(=N2)C(F)(F)F)C(F)(F)F)[N+]3(C(=CC=N3)N)N

InChI

InChI=1S/C13H9F6N6/c14-12(15,16)7-5-8(13(17,18)19)23-11-6(7)1-2-10(24-11)25(21)9(20)3-4-22-25/h1-5H,20-21H2/q+1