4-[2,4-bis(fluoranyl)phenyl]-8-(2-methylphenyl)-7-oxidanidyl-2-piperazin-1-yl-1,7-naphthyridin-7-ium

Systemtic Name: 4-[2,4-bis(fluoranyl)phenyl]-8-(2-methylphenyl)-7-oxidanidyl-2-piperazin-1-yl-1,7-naphthyridin-7-ium Openeye Name: 4-(2,4-difluorophenyl)-8-(o-tolyl)-7-oxido-2-piperazin-1-yl-1,7-naphthyridin-7-ium CAS Name: 4-(2,4-difluorophenyl)-8-(2-methylphenyl)-7-oxido-2-(1-piperazinyl)-1,7-naphthyridin-7-ium IUPAC Name: 4-(2,4-difluorophenyl)-8-(2-methylphenyl)-7-oxido-2-piperazin-1-yl-1,7-naphthyridin-7-ium Traditional Name: 4-(2,4-difluorophenyl)-8-(o-tolyl)-7-oxido-2-piperazino-1,7-naphthyridin-7-ium Formula: C25H22F2N4O MolecularWeight: 432.465186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=[N+](C=CC3=C2N=C(C=C3C4=C(C=C(C=C4)F)F)N5CCNCC5)[O-]

Isomeric SMILES

CC1=CC=CC=C1C2=[N+](C=CC3=C2N=C(C=C3C4=C(C=C(C=C4)F)F)N5CCNCC5)[O-]

InChI

InChI=1S/C25H22F2N4O/c1-16-4-2-3-5-18(16)25-24-20(8-11-31(25)32)21(19-7-6-17(26)14-22(19)27)15-23(29-24)30-12-9-28-10-13-30/h2-8,11,14-15,28H,9-10,12-13H2,1H3