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

Systemtic Name: methyl 4-cyclopropyl-2-fluoranyl-3-methylsulfonyl-benzoate Openeye Name: methyl 4-cyclopropyl-2-fluoro-3-methylsulfonyl-benzoate CAS Name: 4-cyclopropyl-2-fluoro-3-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-cyclopropyl-2-fluoro-3-methylsulfonylbenzoate Traditional Name: 4-cyclopropyl-2-fluoro-3-mesyl-benzoic acid methyl ester Formula: C12H13FO4S MolecularWeight: 272.292623

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C=C1)C2CC2)S(=O)(=O)C)F

Isomeric SMILES

COC(=O)C1=C(C(=C(C=C1)C2CC2)S(=O)(=O)C)F

InChI

InChI=1S/C12H13FO4S/c1-17-12(14)9-6-5-8(7-3-4-7)11(10(9)13)18(2,15)16/h5-7H,3-4H2,1-2H3