3-nitro-4-[2,2,3,3-tetrakis(fluoranyl)propoxy]benzoic acid

Systemtic Name: 3-nitro-4-[2,2,3,3-tetrakis(fluoranyl)propoxy]benzoic acid Openeye Name: 3-nitro-4-(2,2,3,3-tetrafluoropropoxy)benzoic acid CAS Name: 3-nitro-4-(2,2,3,3-tetrafluoropropoxy)benzoic acid IUPAC Name: 3-nitro-4-(2,2,3,3-tetrafluoropropoxy)benzoic acid Traditional Name: 3-nitro-4-(2,2,3,3-tetrafluoropropoxy)benzoic acid Formula: C10H7F4NO5 MolecularWeight: 297.159893

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])OCC(C(F)F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])OCC(C(F)F)(F)F

InChI

InChI=1S/C10H7F4NO5/c11-9(12)10(13,14)4-20-7-2-1-5(8(16)17)3-6(7)15(18)19/h1-3,9H,4H2,(H,16,17)