methyl 2-nitro-5-(trifluoromethyloxy)benzoate

Systemtic Name: methyl 2-nitro-5-(trifluoromethyloxy)benzoate Openeye Name: methyl 2-nitro-5-(trifluoromethoxy)benzoate CAS Name: 2-nitro-5-(trifluoromethoxy)benzoic acid methyl ester IUPAC Name: methyl 2-nitro-5-(trifluoromethoxy)benzoate Traditional Name: 2-nitro-5-(trifluoromethoxy)benzoic acid methyl ester Formula: C9H6F3NO5 MolecularWeight: 265.14285

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6F3NO5/c1-17-8(14)6-4-5(18-9(10,11)12)2-3-7(6)13(15)16/h2-4H,1H3