trideuteriomethyl (1S,5R,6R,7R)-7-deuteriobicyclo[3.2.1]octane-6-carboxylate

Systemtic Name: trideuteriomethyl (1S,5R,6R,7R)-7-deuteriobicyclo[3.2.1]octane-6-carboxylate Openeye Name: trideuteriomethyl (1S,5R,6R,7R)-7-deuteriobicyclo[3.2.1]octane-6-carboxylate CAS Name: (1S,5R,6R,7R)-7-deuterio-6-bicyclo[3.2.1]octanecarboxylic acid trideuteriomethyl ester IUPAC Name: trideuteriomethyl (1S,5R,6R,7R)-7-deuteriobicyclo[3.2.1]octane-6-carboxylate Traditional Name: (1S,5R,6R,7R)-7-deuteriobicyclo[3.2.1]octane-6-carboxylic acid trideuteriomethyl ester Formula: C10H16O2 MolecularWeight: 172.257487

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2CCCC1C2

Isomeric SMILES

[H][C@]1([C@H]2CCC[C@H](C2)[C@@H]1C(=O)OC([2H])([2H])[2H])[2H]

InChI

InChI=1S/C10H16O2/c1-12-10(11)9-6-7-3-2-4-8(9)5-7/h7-9H,2-6H2,1H3/t7-,8+,9+/m0/s1/i1D3,6D/t6-,7+,8-,9-/m1