methyl 2-isocyano-4-methyl-2-(trifluoromethyl)pentanoate

Systemtic Name: methyl 2-isocyano-4-methyl-2-(trifluoromethyl)pentanoate Openeye Name: methyl 2-isocyano-4-methyl-2-(trifluoromethyl)pentanoate CAS Name: 2-isocyano-4-methyl-2-(trifluoromethyl)pentanoic acid methyl ester IUPAC Name: methyl 2-isocyano-4-methyl-2-(trifluoromethyl)pentanoate Traditional Name: 2-isocyano-4-methyl-2-(trifluoromethyl)valeric acid methyl ester Formula: C9H12F3NO2 MolecularWeight: 223.19229

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12F3NO2/c1-6(2)5-8(13-3,7(14)15-4)9(10,11)12/h6H,5H2,1-2,4H3