[(1S,3S)-3-methyl-2-oxidanylidene-3-pentyl-cyclopentyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [(1S,3S)-3-methyl-2-oxidanylidene-3-pentyl-cyclopentyl] 4-fluoranylbenzenesulfonate Openeye Name: [(1S,3S)-3-methyl-2-oxo-3-pentyl-cyclopentyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [(1S,3S)-3-methyl-2-oxo-3-pentylcyclopentyl] ester IUPAC Name: [(1S,3S)-3-methyl-2-oxo-3-pentylcyclopentyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [(1S,3S)-3-amyl-2-keto-3-methyl-cyclopentyl] ester Formula: C17H23FO4S MolecularWeight: 342.425523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CCC(C1=O)OS(=O)(=O)C2=CC=C(C=C2)F)C

Isomeric SMILES

CCCCC[C@]1(CC[C@@H](C1=O)OS(=O)(=O)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C17H23FO4S/c1-3-4-5-11-17(2)12-10-15(16(17)19)22-23(20,21)14-8-6-13(18)7-9-14/h6-9,15H,3-5,10-12H2,1-2H3/t15-,17-/m0/s1