disodium 6-fluoranyl-2-[4-(2-fluorophenyl)phenyl]-3-methyl-quinoline-4-carboxylate

Systemtic Name: disodium 6-fluoranyl-2-[4-(2-fluorophenyl)phenyl]-3-methyl-quinoline-4-carboxylate Openeye Name: disodium 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-3-methyl-quinoline-4-carboxylate CAS Name: disodium 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-3-methyl-4-quinolinecarboxylate IUPAC Name: disodium 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-3-methylquinoline-4-carboxylate Traditional Name: disodium 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-3-methyl-cinchoninate Formula: C23H14F2NNa2O2+ MolecularWeight: 420.339106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)[O-])F)C3=CC=C(C=C3)C4=CC=CC=C4F.[Na+].[Na+]

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)[O-])F)C3=CC=C(C=C3)C4=CC=CC=C4F.[Na+].[Na+]

InChI

InChI=1S/C23H15F2NO2.2Na/c1-13-21(23(27)28)18-12-16(24)10-11-20(18)26-22(13)15-8-6-14(7-9-15)17-4-2-3-5-19(17)25;;/h2-12H,1H3,(H,27,28);;/q;2*+1/p-1