trifluoromethyl 2-methyl-4-nitro-pentanoate

Systemtic Name: trifluoromethyl 2-methyl-4-nitro-pentanoate Openeye Name: trifluoromethyl 2-methyl-4-nitro-pentanoate CAS Name: 2-methyl-4-nitropentanoic acid trifluoromethyl ester IUPAC Name: trifluoromethyl 2-methyl-4-nitropentanoate Traditional Name: 2-methyl-4-nitro-valeric acid trifluoromethyl ester Formula: C7H10F3NO4 MolecularWeight: 229.15381

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H10F3NO4/c1-4(3-5(2)11(13)14)6(12)15-7(8,9)10/h4-5H,3H2,1-2H3