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

Systemtic Name: 4-[2,4-bis(fluoranyl)phenyl]-8-(2-methylphenyl)-7-oxidanidyl-2-piperidin-4-yl-1,7-naphthyridin-7-ium Openeye Name: 4-(2,4-difluorophenyl)-8-(o-tolyl)-7-oxido-2-(4-piperidyl)-1,7-naphthyridin-7-ium CAS Name: 4-(2,4-difluorophenyl)-8-(2-methylphenyl)-7-oxido-2-(4-piperidinyl)-1,7-naphthyridin-7-ium IUPAC Name: 4-(2,4-difluorophenyl)-8-(2-methylphenyl)-7-oxido-2-piperidin-4-yl-1,7-naphthyridin-7-ium Traditional Name: 4-(2,4-difluorophenyl)-8-(o-tolyl)-7-oxido-2-(4-piperidyl)-1,7-naphthyridin-7-ium Formula: C26H23F2N3O MolecularWeight: 431.477126

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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)C5CCNCC5)[O-]

Isomeric SMILES

CC1=CC=CC=C1C2=[N+](C=CC3=C2N=C(C=C3C4=C(C=C(C=C4)F)F)C5CCNCC5)[O-]

InChI

InChI=1S/C26H23F2N3O/c1-16-4-2-3-5-19(16)26-25-21(10-13-31(26)32)22(20-7-6-18(27)14-23(20)28)15-24(30-25)17-8-11-29-12-9-17/h2-7,10,13-15,17,29H,8-9,11-12H2,1H3