3-propylsulfanylpropyl (1R,4S,5S)-4-fluoranyl-3-oxidanylidene-8-azabicyclo[3.2.1]octane-8-carboxylate

Systemtic Name: 3-propylsulfanylpropyl (1R,4S,5S)-4-fluoranyl-3-oxidanylidene-8-azabicyclo[3.2.1]octane-8-carboxylate Openeye Name: 3-propylsulfanylpropyl (1R,4S,5S)-4-fluoro-3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate CAS Name: (1R,4S,5S)-4-fluoro-3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylic acid 3-(propylthio)propyl ester IUPAC Name: 3-propylsulfanylpropyl (1R,4S,5S)-4-fluoro-3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate Traditional Name: (1R,4S,5S)-4-fluoro-3-keto-8-azabicyclo[3.2.1]octane-8-carboxylic acid 3-(propylthio)propyl ester Formula: C14H22FNO3S MolecularWeight: 303.392783

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCCCOC(=O)N1C2CCC1C(C(=O)C2)F

Isomeric SMILES

CCCSCCCOC(=O)N1[C@@H]2CC[C@H]1[C@@H](C(=O)C2)F

InChI

InChI=1S/C14H22FNO3S/c1-2-7-20-8-3-6-19-14(18)16-10-4-5-11(16)13(15)12(17)9-10/h10-11,13H,2-9H2,1H3/t10-,11+,13+/m1/s1