sodium 2-[4-(4-fluorophenyl)phenyl]oct-3-yn-2-olate

Systemtic Name: sodium 2-[4-(4-fluorophenyl)phenyl]oct-3-yn-2-olate Openeye Name: sodium 2-[4-(4-fluorophenyl)phenyl]oct-3-yn-2-olate CAS Name: sodium 2-[4-(4-fluorophenyl)phenyl]-3-octyn-2-olate IUPAC Name: sodium 2-[4-(4-fluorophenyl)phenyl]oct-3-yn-2-olate Traditional Name: sodium 2-[4-(4-fluorophenyl)phenyl]oct-3-yn-2-olate Formula: C20H20FNaO MolecularWeight: 318.360373

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(C)(C1=CC=C(C=C1)C2=CC=C(C=C2)F)[O-].[Na+]

Isomeric SMILES

CCCCC#CC(C)(C1=CC=C(C=C1)C2=CC=C(C=C2)F)[O-].[Na+]

InChI

InChI=1S/C20H20FO.Na/c1-3-4-5-6-15-20(2,22)18-11-7-16(8-12-18)17-9-13-19(21)14-10-17;/h7-14H,3-5H2,1-2H3;/q-1;+1