methyl 4-cyclopentyl-2-fluoranyl-3-methylsulfonyl-benzoate

Systemtic Name: methyl 4-cyclopentyl-2-fluoranyl-3-methylsulfonyl-benzoate Openeye Name: methyl 4-cyclopentyl-2-fluoro-3-methylsulfonyl-benzoate CAS Name: 4-cyclopentyl-2-fluoro-3-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-cyclopentyl-2-fluoro-3-methylsulfonylbenzoate Traditional Name: 4-cyclopentyl-2-fluoro-3-mesyl-benzoic acid methyl ester Formula: C14H17FO4S MolecularWeight: 300.345783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C=C1)C2CCCC2)S(=O)(=O)C)F

Isomeric SMILES

COC(=O)C1=C(C(=C(C=C1)C2CCCC2)S(=O)(=O)C)F

InChI

InChI=1S/C14H17FO4S/c1-19-14(16)11-8-7-10(9-5-3-4-6-9)13(12(11)15)20(2,17)18/h7-9H,3-6H2,1-2H3