[(5S,7R)-3-(fluoranylmethyl)-1-adamantyl] ethanoate

Systemtic Name: [(5S,7R)-3-(fluoranylmethyl)-1-adamantyl] ethanoate Openeye Name: [(5S,7R)-3-(fluoromethyl)-1-adamantyl] acetate CAS Name: acetic acid [(5S,7R)-3-(fluoromethyl)-1-adamantyl] ester IUPAC Name: [(5S,7R)-3-(fluoromethyl)-1-adamantyl] acetate Traditional Name: acetic acid [(5S,7R)-3-(fluoromethyl)-1-adamantyl] ester Formula: C13H19FO2 MolecularWeight: 226.287163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC12CC3CC(C1)CC(C3)(C2)CF

Isomeric SMILES

CC(=O)OC12C[C@@H]3C[C@H](C1)CC(C3)(C2)CF

InChI

InChI=1S/C13H19FO2/c1-9(15)16-13-5-10-2-11(6-13)4-12(3-10,7-13)8-14/h10-11H,2-8H2,1H3/t10-,11+,12?,13?