5-[3-(3-ethoxy-3-oxidanylidene-propyl)-4-(trifluoromethylsulfonyloxy)phenyl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[3-(3-ethoxy-3-oxidanylidene-propyl)-4-(trifluoromethylsulfonyloxy)phenyl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[3-(3-ethoxy-3-oxo-propyl)-4-(trifluoromethylsulfonyloxy)phenyl]-5-oxo-pentanoic acid CAS Name: 5-[3-(3-ethoxy-3-oxopropyl)-4-(trifluoromethylsulfonyloxy)phenyl]-5-oxopentanoic acid IUPAC Name: 5-[3-(3-ethoxy-3-oxopropyl)-4-(trifluoromethylsulfonyloxy)phenyl]-5-oxopentanoic acid Traditional Name: 5-[3-(3-ethoxy-3-keto-propyl)-4-triflyloxy-phenyl]-5-keto-valeric acid Formula: C17H19F3O8S MolecularWeight: 440.38817

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C=CC(=C1)C(=O)CCCC(=O)O)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCOC(=O)CCC1=C(C=CC(=C1)C(=O)CCCC(=O)O)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C17H19F3O8S/c1-2-27-16(24)9-7-12-10-11(13(21)4-3-5-15(22)23)6-8-14(12)28-29(25,26)17(18,19)20/h6,8,10H,2-5,7,9H2,1H3,(H,22,23)