methyl 5,5,5-tris(fluoranyl)-4-methyl-4-nitro-pentanoate

Systemtic Name: methyl 5,5,5-tris(fluoranyl)-4-methyl-4-nitro-pentanoate Openeye Name: methyl 5,5,5-trifluoro-4-methyl-4-nitro-pentanoate CAS Name: 5,5,5-trifluoro-4-methyl-4-nitropentanoic acid methyl ester IUPAC Name: methyl 5,5,5-trifluoro-4-methyl-4-nitropentanoate Traditional Name: 5,5,5-trifluoro-4-methyl-4-nitro-valeric acid methyl ester Formula: C7H10F3NO4 MolecularWeight: 229.15381

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H10F3NO4/c1-6(11(13)14,7(8,9)10)4-3-5(12)15-2/h3-4H2,1-2H3