sodium 6-fluoranyl-3-methyl-2-(3-phenylphenoxy)quinoline-4-carboxylate

Systemtic Name: sodium 6-fluoranyl-3-methyl-2-(3-phenylphenoxy)quinoline-4-carboxylate Openeye Name: sodium 6-fluoro-3-methyl-2-(3-phenylphenoxy)quinoline-4-carboxylate CAS Name: sodium 6-fluoro-3-methyl-2-(3-phenylphenoxy)-4-quinolinecarboxylate IUPAC Name: sodium 6-fluoro-3-methyl-2-(3-phenylphenoxy)quinoline-4-carboxylate Traditional Name: sodium 6-fluoro-3-methyl-2-(3-phenylphenoxy)cinchoninate Formula: C23H15FNNaO3 MolecularWeight: 395.358273

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)[O-])F)OC3=CC=CC(=C3)C4=CC=CC=C4.[Na+]

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)[O-])F)OC3=CC=CC(=C3)C4=CC=CC=C4.[Na+]

InChI

InChI=1S/C23H16FNO3.Na/c1-14-21(23(26)27)19-13-17(24)10-11-20(19)25-22(14)28-18-9-5-8-16(12-18)15-6-3-2-4-7-15;/h2-13H,1H3,(H,26,27);/q;+1/p-1