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

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 4-methylsulfonylbenzoate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 4-methylsulfonylbenzoate Traditional Name: 4-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=C(C=C1)C(=O)OCCCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

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

InChI

InChI=1S/C18H17FO5S/c1-25(22,23)16-10-6-14(7-11-16)18(21)24-12-2-3-17(20)13-4-8-15(19)9-5-13/h4-11H,2-3,12H2,1H3