methyl 4-chloranyl-2-nitro-5-(trifluoromethyl)benzoate

Systemtic Name: methyl 4-chloranyl-2-nitro-5-(trifluoromethyl)benzoate Openeye Name: methyl 4-chloro-2-nitro-5-(trifluoromethyl)benzoate CAS Name: 4-chloro-2-nitro-5-(trifluoromethyl)benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-nitro-5-(trifluoromethyl)benzoate Traditional Name: 4-chloro-2-nitro-5-(trifluoromethyl)benzoic acid methyl ester Formula: C9H5ClF3NO4 MolecularWeight: 283.58851

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H5ClF3NO4/c1-18-8(15)4-2-5(9(11,12)13)6(10)3-7(4)14(16)17/h2-3H,1H3