13-[2-(4-oxidanyl-4-oxidanylidene-butoxy)-4-(trifluoromethyl)phenoxy]tridecanoic acid

Systemtic Name: 13-[2-(4-oxidanyl-4-oxidanylidene-butoxy)-4-(trifluoromethyl)phenoxy]tridecanoic acid Openeye Name: 13-[2-(4-hydroxy-4-oxo-butoxy)-4-(trifluoromethyl)phenoxy]tridecanoic acid CAS Name: 13-[2-(4-hydroxy-4-oxobutoxy)-4-(trifluoromethyl)phenoxy]tridecanoic acid IUPAC Name: 13-[2-(4-hydroxy-4-oxobutoxy)-4-(trifluoromethyl)phenoxy]tridecanoic acid Traditional Name: 13-[2-(4-hydroxy-4-keto-butoxy)-4-(trifluoromethyl)phenoxy]tridecanoic acid Formula: C24H35F3O6 MolecularWeight: 476.52631

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)OCCCC(=O)O)OCCCCCCCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)OCCCC(=O)O)OCCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C24H35F3O6/c25-24(26,27)19-14-15-20(21(18-19)33-17-11-13-23(30)31)32-16-10-8-6-4-2-1-3-5-7-9-12-22(28)29/h14-15,18H,1-13,16-17H2,(H,28,29)(H,30,31)