methyl 2-(fluoranylmethyl)-4-methyl-3-methylsulfonyl-benzoate

Systemtic Name: methyl 2-(fluoranylmethyl)-4-methyl-3-methylsulfonyl-benzoate Openeye Name: methyl 2-(fluoromethyl)-4-methyl-3-methylsulfonyl-benzoate CAS Name: 2-(fluoromethyl)-4-methyl-3-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 2-(fluoromethyl)-4-methyl-3-methylsulfonylbenzoate Traditional Name: 2-(fluoromethyl)-3-mesyl-4-methyl-benzoic acid methyl ester Formula: C11H13FO4S MolecularWeight: 260.281923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)OC)CF)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)OC)CF)S(=O)(=O)C

InChI

InChI=1S/C11H13FO4S/c1-7-4-5-8(11(13)16-2)9(6-12)10(7)17(3,14)15/h4-5H,6H2,1-3H3