3-nitro-4-[3-(trifluoromethyl)phenyl]benzoic acid

Systemtic Name: 3-nitro-4-[3-(trifluoromethyl)phenyl]benzoic acid Openeye Name: 3-nitro-4-[3-(trifluoromethyl)phenyl]benzoic acid CAS Name: 3-nitro-4-[3-(trifluoromethyl)phenyl]benzoic acid IUPAC Name: 3-nitro-4-[3-(trifluoromethyl)phenyl]benzoic acid Traditional Name: 3-nitro-4-[3-(trifluoromethyl)phenyl]benzoic acid Formula: C14H8F3NO4 MolecularWeight: 311.21283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H8F3NO4/c15-14(16,17)10-3-1-2-8(6-10)11-5-4-9(13(19)20)7-12(11)18(21)22/h1-7H,(H,19,20)