[2,3,6-tris(fluoranyl)phenyl] 10-methylacridin-10-ium-9-carboxylate

Systemtic Name: [2,3,6-tris(fluoranyl)phenyl] 10-methylacridin-10-ium-9-carboxylate Openeye Name: (2,3,6-trifluorophenyl) 10-methylacridin-10-ium-9-carboxylate CAS Name: 10-methyl-9-acridin-10-iumcarboxylic acid (2,3,6-trifluorophenyl) ester IUPAC Name: (2,3,6-trifluorophenyl) 10-methylacridin-10-ium-9-carboxylate Traditional Name: 10-methylacridin-10-ium-9-carboxylic acid (2,3,6-trifluorophenyl) ester Formula: C21H13F3NO2+ MolecularWeight: 368.32863

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=CC=CC2=C(C3=CC=CC=C31)C(=O)OC4=C(C=CC(=C4F)F)F

Isomeric SMILES

C[N+]1=C2C=CC=CC2=C(C3=CC=CC=C31)C(=O)OC4=C(C=CC(=C4F)F)F

InChI

InChI=1S/C21H13F3NO2/c1-25-16-8-4-2-6-12(16)18(13-7-3-5-9-17(13)25)21(26)27-20-15(23)11-10-14(22)19(20)24/h2-11H,1H3/q+1