3,3,3-tris(fluoranyl)-2-pentoxycarbonyl-propanoic acid

Systemtic Name: 3,3,3-tris(fluoranyl)-2-pentoxycarbonyl-propanoic acid Openeye Name: 3,3,3-trifluoro-2-pentoxycarbonyl-propanoic acid CAS Name: 3,3,3-trifluoro-2-[oxo(pentoxy)methyl]propanoic acid IUPAC Name: 3,3,3-trifluoro-2-pentoxycarbonylpropanoic acid Traditional Name: 2-amoxycarbonyl-3,3,3-trifluoro-propionic acid Formula: C9H13F3O4 MolecularWeight: 242.19233

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(C(=O)O)C(F)(F)F

Isomeric SMILES

CCCCCOC(=O)C(C(=O)O)C(F)(F)F

InChI

InChI=1S/C9H13F3O4/c1-2-3-4-5-16-8(15)6(7(13)14)9(10,11)12/h6H,2-5H2,1H3,(H,13,14)