4-(1-cyanocyclopropyl)-2,3,5-tris(fluoranyl)benzoic acid

Systemtic Name: 4-(1-cyanocyclopropyl)-2,3,5-tris(fluoranyl)benzoic acid Openeye Name: 4-(1-cyanocyclopropyl)-2,3,5-trifluoro-benzoic acid CAS Name: 4-(1-cyanocyclopropyl)-2,3,5-trifluorobenzoic acid IUPAC Name: 4-(1-cyanocyclopropyl)-2,3,5-trifluorobenzoic acid Traditional Name: 4-(1-cyanocyclopropyl)-2,3,5-trifluoro-benzoic acid Formula: C11H6F3NO2 MolecularWeight: 241.16605

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C#N)C2=C(C=C(C(=C2F)F)C(=O)O)F

Isomeric SMILES

C1CC1(C#N)C2=C(C=C(C(=C2F)F)C(=O)O)F

InChI

InChI=1S/C11H6F3NO2/c12-6-3-5(10(16)17)8(13)9(14)7(6)11(4-15)1-2-11/h3H,1-2H2,(H,16,17)