7-(4-pyrimidin-2-ylpiperazin-1-yl)-2,4-bis(trifluoromethyl)-1,8-naphthyridin-8-ium

Systemtic Name: 7-(4-pyrimidin-2-ylpiperazin-1-yl)-2,4-bis(trifluoromethyl)-1,8-naphthyridin-8-ium Openeye Name: 7-(4-pyrimidin-2-ylpiperazin-1-yl)-2,4-bis(trifluoromethyl)-1,8-naphthyridin-8-ium CAS Name: 7-[4-(2-pyrimidinyl)-1-piperazinyl]-2,4-bis(trifluoromethyl)-1,8-naphthyridin-8-ium IUPAC Name: 7-(4-pyrimidin-2-ylpiperazin-1-yl)-2,4-bis(trifluoromethyl)-1,8-naphthyridin-8-ium Traditional Name: 7-[4-(2-pyrimidyl)piperazino]-2,4-bis(trifluoromethyl)-1,8-naphthyridin-8-ium Formula: C18H15F6N6+ MolecularWeight: 429.342319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=[NH+]C3=C(C=C2)C(=CC(=N3)C(F)(F)F)C(F)(F)F)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1C2=[NH+]C3=C(C=C2)C(=CC(=N3)C(F)(F)F)C(F)(F)F)C4=NC=CC=N4

InChI

InChI=1S/C18H14F6N6/c19-17(20,21)12-10-13(18(22,23)24)27-15-11(12)2-3-14(28-15)29-6-8-30(9-7-29)16-25-4-1-5-26-16/h1-5,10H,6-9H2/p+1