sodium 9-fluoranyl-3-phenyl-5,6-dihydrobenzo[b][1,7]phenanthroline-7-carboxylate

Systemtic Name: sodium 9-fluoranyl-3-phenyl-5,6-dihydrobenzo[b][1,7]phenanthroline-7-carboxylate Openeye Name: sodium 9-fluoro-3-phenyl-5,6-dihydrobenzo[b][1,7]phenanthroline-7-carboxylate CAS Name: sodium 9-fluoro-3-phenyl-5,6-dihydrobenzo[b][1,7]phenanthroline-7-carboxylate IUPAC Name: sodium 9-fluoro-3-phenyl-5,6-dihydrobenzo[b][1,7]phenanthroline-7-carboxylate Traditional Name: sodium 9-fluoro-3-phenyl-5,6-dihydrobenzo[b][1,7]phenanthroline-7-carboxylate Formula: C23H14FN2NaO2 MolecularWeight: 392.357633

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=N2)C3=CC=CC=C3)C4=C1C(=C5C=C(C=CC5=N4)F)C(=O)[O-].[Na+]

Isomeric SMILES

C1CC2=C(C=CC(=N2)C3=CC=CC=C3)C4=C1C(=C5C=C(C=CC5=N4)F)C(=O)[O-].[Na+]

InChI

InChI=1S/C23H15FN2O2.Na/c24-14-6-9-20-17(12-14)21(23(27)28)16-8-11-19-15(22(16)26-20)7-10-18(25-19)13-4-2-1-3-5-13;/h1-7,9-10,12H,8,11H2,(H,27,28);/q;+1/p-1