[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-methylsulfonylbenzoate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-methylsulfonylbenzoate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C18H17FO5S MolecularWeight: 364.387983

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)OCCCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)OCCCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H17FO5S/c1-25(22,23)17-7-3-2-5-15(17)18(21)24-12-4-6-16(20)13-8-10-14(19)11-9-13/h2-3,5,7-11H,4,6,12H2,1H3