4-chloranyl-3-nitro-5-(trifluoromethyl)benzoic acid

Systemtic Name: 4-chloranyl-3-nitro-5-(trifluoromethyl)benzoic acid Openeye Name: 4-chloro-3-nitro-5-(trifluoromethyl)benzoic acid CAS Name: 4-chloro-3-nitro-5-(trifluoromethyl)benzoic acid IUPAC Name: 4-chloro-3-nitro-5-(trifluoromethyl)benzoic acid Traditional Name: 4-chloro-3-nitro-5-(trifluoromethyl)benzoic acid Formula: C8H3ClF3NO4 MolecularWeight: 269.56193

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H3ClF3NO4/c9-6-4(8(10,11)12)1-3(7(14)15)2-5(6)13(16)17/h1-2H,(H,14,15)