2-[9-(2-ethanoylphenoxy)carbonylacridin-10-ium-10-yl]ethanoic acid; tris(fluoranyl)methanesulfonate

Systemtic Name: 2-[9-(2-ethanoylphenoxy)carbonylacridin-10-ium-10-yl]ethanoic acid; tris(fluoranyl)methanesulfonate Openeye Name: 2-[9-(2-acetylphenoxy)carbonylacridin-10-ium-10-yl]acetic acid; trifluoromethanesulfonate CAS Name: 2-[9-[(2-acetylphenoxy)-oxomethyl]-10-acridin-10-iumyl]acetic acid; trifluoromethanesulfonate IUPAC Name: 2-[9-(2-acetylphenoxy)carbonylacridin-10-ium-10-yl]acetic acid; trifluoromethanesulfonate Traditional Name: 2-[9-(2-acetylphenoxy)carbonylacridin-10-ium-10-yl]acetic acid triflate Formula: C25H18F3NO8S MolecularWeight: 549.47253

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1OC(=O)C2=C3C=CC=CC3=[N+](C4=CC=CC=C42)CC(=O)O.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=CC=C1OC(=O)C2=C3C=CC=CC3=[N+](C4=CC=CC=C42)CC(=O)O.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C24H17NO5.CHF3O3S/c1-15(26)16-8-4-7-13-21(16)30-24(29)23-17-9-2-5-11-19(17)25(14-22(27)28)20-12-6-3-10-18(20)23;2-1(3,4)8(5,6)7/h2-13H,14H2,1H3;(H,5,6,7)