(2-methoxy-5-nitro-phenyl)methyl 3-(trifluoromethyl)benzoate

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl 3-(trifluoromethyl)benzoate Openeye Name: (2-methoxy-5-nitro-phenyl)methyl 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid (2-methoxy-5-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-5-nitrophenyl)methyl 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid (2-methoxy-5-nitro-benzyl) ester Formula: C16H12F3NO5 MolecularWeight: 355.26539

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C16H12F3NO5/c1-24-14-6-5-13(20(22)23)8-11(14)9-25-15(21)10-3-2-4-12(7-10)16(17,18)19/h2-8H,9H2,1H3