tert-butyl 2-cyclopropylcarbonyl-3-(2-fluoranyl-4-methylsulfonyl-phenyl)-3-oxidanylidene-propanoate

Systemtic Name: tert-butyl 2-cyclopropylcarbonyl-3-(2-fluoranyl-4-methylsulfonyl-phenyl)-3-oxidanylidene-propanoate Openeye Name: tert-butyl 2-(cyclopropanecarbonyl)-3-(2-fluoro-4-methylsulfonyl-phenyl)-3-oxo-propanoate CAS Name: 2-[cyclopropyl(oxo)methyl]-3-(2-fluoro-4-methylsulfonylphenyl)-3-oxopropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(cyclopropanecarbonyl)-3-(2-fluoro-4-methylsulfonylphenyl)-3-oxopropanoate Traditional Name: 2-(cyclopropanecarbonyl)-3-(2-fluoro-4-mesyl-phenyl)-3-keto-propionic acid tert-butyl ester Formula: C18H21FO6S MolecularWeight: 384.419143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(=O)C1CC1)C(=O)C2=C(C=C(C=C2)S(=O)(=O)C)F

Isomeric SMILES

CC(C)(C)OC(=O)C(C(=O)C1CC1)C(=O)C2=C(C=C(C=C2)S(=O)(=O)C)F

InChI

InChI=1S/C18H21FO6S/c1-18(2,3)25-17(22)14(15(20)10-5-6-10)16(21)12-8-7-11(9-13(12)19)26(4,23)24/h7-10,14H,5-6H2,1-4H3