methyl 4,4,4-tris(fluoranyl)-3-methoxy-3-(3-nitrophenyl)butanoate

Systemtic Name: methyl 4,4,4-tris(fluoranyl)-3-methoxy-3-(3-nitrophenyl)butanoate Openeye Name: methyl 4,4,4-trifluoro-3-methoxy-3-(3-nitrophenyl)butanoate CAS Name: 4,4,4-trifluoro-3-methoxy-3-(3-nitrophenyl)butanoic acid methyl ester IUPAC Name: methyl 4,4,4-trifluoro-3-methoxy-3-(3-nitrophenyl)butanoate Traditional Name: 4,4,4-trifluoro-3-methoxy-3-(3-nitrophenyl)butyric acid methyl ester Formula: C12H12F3NO5 MolecularWeight: 307.22259

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12F3NO5/c1-20-10(17)7-11(21-2,12(13,14)15)8-4-3-5-9(6-8)16(18)19/h3-6H,7H2,1-2H3