[2,3,6-tris(fluoranyl)phenyl] 1,6-dimethoxy-4,10-dimethyl-acridin-10-ium-9-carboxylate

Systemtic Name: [2,3,6-tris(fluoranyl)phenyl] 1,6-dimethoxy-4,10-dimethyl-acridin-10-ium-9-carboxylate Openeye Name: (2,3,6-trifluorophenyl) 1,6-dimethoxy-4,10-dimethyl-acridin-10-ium-9-carboxylate CAS Name: 1,6-dimethoxy-4,10-dimethyl-9-acridin-10-iumcarboxylic acid (2,3,6-trifluorophenyl) ester IUPAC Name: (2,3,6-trifluorophenyl) 1,6-dimethoxy-4,10-dimethylacridin-10-ium-9-carboxylate Traditional Name: 1,6-dimethoxy-4,10-dimethyl-acridin-10-ium-9-carboxylic acid (2,3,6-trifluorophenyl) ester Formula: C24H19F3NO4+ MolecularWeight: 442.40717

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)OC)C(=C3C=CC(=CC3=[N+]2C)OC)C(=O)OC4=C(C=CC(=C4F)F)F

Isomeric SMILES

CC1=C2C(=C(C=C1)OC)C(=C3C=CC(=CC3=[N+]2C)OC)C(=O)OC4=C(C=CC(=C4F)F)F

InChI

InChI=1S/C24H19F3NO4/c1-12-5-10-18(31-4)20-19(24(29)32-23-16(26)9-8-15(25)21(23)27)14-7-6-13(30-3)11-17(14)28(2)22(12)20/h5-11H,1-4H3/q+1