cyanomethyl (5S,7R)-3-oxidanyladamantane-1-carboxylate

Systemtic Name: cyanomethyl (5S,7R)-3-oxidanyladamantane-1-carboxylate Openeye Name: cyanomethyl (5S,7R)-3-hydroxyadamantane-1-carboxylate CAS Name: (5S,7R)-3-hydroxy-1-adamantanecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl (5S,7R)-3-hydroxyadamantane-1-carboxylate Traditional Name: (5S,7R)-3-hydroxyadamantane-1-carboxylic acid cyanomethyl ester Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C(=O)OCC#N

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)O)C(=O)OCC#N

InChI

InChI=1S/C13H17NO3/c14-1-2-17-11(15)12-4-9-3-10(5-12)7-13(16,6-9)8-12/h9-10,16H,2-8H2/t9-,10+,12?,13?