methyl 2-nitro-3-oxidanyl-4-(trifluoromethyl)benzoate

Systemtic Name: methyl 2-nitro-3-oxidanyl-4-(trifluoromethyl)benzoate Openeye Name: methyl 3-hydroxy-2-nitro-4-(trifluoromethyl)benzoate CAS Name: 3-hydroxy-2-nitro-4-(trifluoromethyl)benzoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-nitro-4-(trifluoromethyl)benzoate Traditional Name: 3-hydroxy-2-nitro-4-(trifluoromethyl)benzoic acid methyl ester Formula: C9H6F3NO5 MolecularWeight: 265.14285

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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