16-[3-(trifluoromethyl)phenoxy]hexadeca-5,8,11,14-tetraynoic acid

Systemtic Name: 16-[3-(trifluoromethyl)phenoxy]hexadeca-5,8,11,14-tetraynoic acid Openeye Name: 16-[3-(trifluoromethyl)phenoxy]hexadeca-5,8,11,14-tetraynoic acid CAS Name: 16-[3-(trifluoromethyl)phenoxy]hexadeca-5,8,11,14-tetraynoic acid IUPAC Name: 16-[3-(trifluoromethyl)phenoxy]hexadeca-5,8,11,14-tetraynoic acid Traditional Name: 16-[3-(trifluoromethyl)phenoxy]hexadeca-5,8,11,14-tetraynoic acid Formula: C23H19F3O3 MolecularWeight: 400.39037

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC#CCC#CCC#CCC#CCCCC(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)OCC#CCC#CCC#CCC#CCCCC(=O)O)C(F)(F)F

InChI

InChI=1S/C23H19F3O3/c24-23(25,26)20-15-14-16-21(19-20)29-18-13-11-9-7-5-3-1-2-4-6-8-10-12-17-22(27)28/h14-16,19H,3-4,9-10,12,17-18H2,(H,27,28)