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methyl 3-methylsulfonyl-4-(trifluoromethyl)benzoate

methyl 3-methylsulfonyl-4-(trifluoromethyl)benzoate

Systemtic Name:methyl 3-methylsulfonyl-4-(trifluoromethyl)benzoate
Openeye Name:methyl 3-methylsulfonyl-4-(trifluoromethyl)benzoate
CAS Name:3-methylsulfonyl-4-(trifluoromethyl)benzoic acid methyl ester
IUPAC Name:methyl 3-methylsulfonyl-4-(trifluoromethyl)benzoate
Traditional Name:3-mesyl-4-(trifluoromethyl)benzoic acid methyl ester
Formula: C10H9F3O4S
MolecularWeight: 282.23627
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(F)(F)F)S(=O)(=O)C


Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(F)(F)F)S(=O)(=O)C


InChI

InChI=1S/C10H9F3O4S/c1-17-9(14)6-3-4-7(10(11,12)13)8(5-6)18(2,15)16/h3-5H,1-2H3


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