methyl 5-[(2-methylpropylamino)methyl]-2-(trifluoromethylperoxysulfanyloxy)benzoate

Systemtic Name: methyl 5-[(2-methylpropylamino)methyl]-2-(trifluoromethylperoxysulfanyloxy)benzoate Openeye Name: methyl 5-[(isobutylamino)methyl]-2-(trifluoromethylperoxysulfanyloxy)benzoate CAS Name: 5-[(2-methylpropylamino)methyl]-2-(trifluoromethyldioxythio)oxybenzoic acid methyl ester IUPAC Name: methyl 5-[(2-methylpropylamino)methyl]-2-(trifluoromethylperoxysulfanyloxy)benzoate Traditional Name: 5-[(isobutylamino)methyl]-2-(trifluoromethylperoxythio)oxy-benzoic acid methyl ester Formula: C14H18F3NO5S MolecularWeight: 369.35663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCC1=CC(=C(C=C1)OSOOC(F)(F)F)C(=O)OC

Isomeric SMILES

CC(C)CNCC1=CC(=C(C=C1)OSOOC(F)(F)F)C(=O)OC

InChI

InChI=1S/C14H18F3NO5S/c1-9(2)7-18-8-10-4-5-12(11(6-10)13(19)20-3)21-24-23-22-14(15,16)17/h4-6,9,18H,7-8H2,1-3H3