2-oxidanyl-4-oxidanylidene-3-(3-phenoxyphenyl)-1H-quinoline-7-diazonium; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: 2-oxidanyl-4-oxidanylidene-3-(3-phenoxyphenyl)-1H-quinoline-7-diazonium; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: 2-hydroxy-4-oxo-3-(3-phenoxyphenyl)-1H-quinoline-7-diazonium; 2,2,2-trifluoroacetate CAS Name: 2-hydroxy-4-oxo-3-(3-phenoxyphenyl)-1H-quinoline-7-diazonium; 2,2,2-trifluoroacetate IUPAC Name: 2-hydroxy-4-oxo-3-(3-phenoxyphenyl)-1H-quinoline-7-diazonium; 2,2,2-trifluoroacetate Traditional Name: 2-hydroxy-4-keto-3-(3-phenoxyphenyl)-1H-quinoline-7-diazonium; 2,2,2-trifluoroacetate Formula: C23H14F3N3O5 MolecularWeight: 469.36957

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=C(NC4=C(C3=O)C=CC(=C4)[N+]#N)O.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=C(NC4=C(C3=O)C=CC(=C4)[N+]#N)O.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C21H13N3O3.C2HF3O2/c22-24-14-9-10-17-18(12-14)23-21(26)19(20(17)25)13-5-4-8-16(11-13)27-15-6-2-1-3-7-15;3-2(4,5)1(6)7/h1-12H,(H-,23,25,26);(H,6,7)