(E,2R)-5-fluoranyl-2-(trimethylazaniumyl)octadec-3-en-1-olate

Systemtic Name: (E,2R)-5-fluoranyl-2-(trimethylazaniumyl)octadec-3-en-1-olate Openeye Name: (E,2R)-5-fluoro-2-(trimethylammonio)octadec-3-en-1-olate CAS Name: (E,2R)-5-fluoro-2-(trimethylammonio)-3-octadecen-1-olate IUPAC Name: (E,2R)-5-fluoro-2-(trimethylazaniumyl)octadec-3-en-1-olate Traditional Name: (E,2R)-5-fluoro-2-(trimethylammonio)octadec-3-en-1-olate Formula: C21H42FNO MolecularWeight: 343.562683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C=CC(C[O-])[N+](C)(C)C)F

Isomeric SMILES

CCCCCCCCCCCCCC(/C=C/[C@H](C[O-])[N+](C)(C)C)F

InChI

InChI=1S/C21H42FNO/c1-5-6-7-8-9-10-11-12-13-14-15-16-20(22)17-18-21(19-24)23(2,3)4/h17-18,20-21H,5-16,19H2,1-4H3/b18-17+/t20?,21-/m1/s1