methyl 2-(fluoranylmethyl)-5-methylsulfonyl-4-pyridin-3-yl-benzoate

Systemtic Name: methyl 2-(fluoranylmethyl)-5-methylsulfonyl-4-pyridin-3-yl-benzoate Openeye Name: methyl 2-(fluoromethyl)-5-methylsulfonyl-4-(3-pyridyl)benzoate CAS Name: 2-(fluoromethyl)-5-methylsulfonyl-4-(3-pyridinyl)benzoic acid methyl ester IUPAC Name: methyl 2-(fluoromethyl)-5-methylsulfonyl-4-pyridin-3-ylbenzoate Traditional Name: 2-(fluoromethyl)-5-mesyl-4-(3-pyridyl)benzoic acid methyl ester Formula: C15H14FNO4S MolecularWeight: 323.339363

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C(=C1)S(=O)(=O)C)C2=CN=CC=C2)CF

Isomeric SMILES

COC(=O)C1=C(C=C(C(=C1)S(=O)(=O)C)C2=CN=CC=C2)CF

InChI

InChI=1S/C15H14FNO4S/c1-21-15(18)13-7-14(22(2,19)20)12(6-11(13)8-16)10-4-3-5-17-9-10/h3-7,9H,8H2,1-2H3