6-[3,4,8-tris(fluoranyl)octan-2-yloxycarbonyl]naphthalene-2-carboxylic acid

Systemtic Name: 6-[3,4,8-tris(fluoranyl)octan-2-yloxycarbonyl]naphthalene-2-carboxylic acid Openeye Name: 6-(2,3,7-trifluoro-1-methyl-heptoxy)carbonylnaphthalene-2-carboxylic acid CAS Name: 6-[oxo(3,4,8-trifluorooctan-2-yloxy)methyl]-2-naphthalenecarboxylic acid IUPAC Name: 6-(3,4,8-trifluorooctan-2-yloxycarbonyl)naphthalene-2-carboxylic acid Traditional Name: 6-(2,3,7-trifluoro-1-methyl-heptoxy)carbonyl-2-naphthoic acid Formula: C20H21F3O4 MolecularWeight: 382.37355

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(CCCCF)F)F)OC(=O)C1=CC2=C(C=C1)C=C(C=C2)C(=O)O

Isomeric SMILES

CC(C(C(CCCCF)F)F)OC(=O)C1=CC2=C(C=C1)C=C(C=C2)C(=O)O

InChI

InChI=1S/C20H21F3O4/c1-12(18(23)17(22)4-2-3-9-21)27-20(26)16-8-6-13-10-15(19(24)25)7-5-14(13)11-16/h5-8,10-12,17-18H,2-4,9H2,1H3,(H,24,25)