4,4,4-tris(fluoranyl)-2,2-diphenoxy-butanoic acid

Systemtic Name: 4,4,4-tris(fluoranyl)-2,2-diphenoxy-butanoic acid Openeye Name: 4,4,4-trifluoro-2,2-diphenoxy-butanoic acid CAS Name: 4,4,4-trifluoro-2,2-diphenoxybutanoic acid IUPAC Name: 4,4,4-trifluoro-2,2-diphenoxybutanoic acid Traditional Name: 4,4,4-trifluoro-2,2-diphenoxy-butyric acid Formula: C16H13F3O4 MolecularWeight: 326.26723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(CC(F)(F)F)(C(=O)O)OC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)OC(CC(F)(F)F)(C(=O)O)OC2=CC=CC=C2

InChI

InChI=1S/C16H13F3O4/c17-16(18,19)11-15(14(20)21,22-12-7-3-1-4-8-12)23-13-9-5-2-6-10-13/h1-10H,11H2,(H,20,21)