2-[(1S,5R)-3,3,5-trimethylcyclohexyl]oxypyridine-4-carboxylate

Systemtic Name: 2-[(1S,5R)-3,3,5-trimethylcyclohexyl]oxypyridine-4-carboxylate Openeye Name: 2-[(1S,5R)-3,3,5-trimethylcyclohexoxy]pyridine-4-carboxylate CAS Name: 2-[(1S,5R)-3,3,5-trimethylcyclohexyl]oxy-4-pyridinecarboxylate IUPAC Name: 2-[(1S,5R)-3,3,5-trimethylcyclohexyl]oxypyridine-4-carboxylate Traditional Name: 2-[(1S,5R)-3,3,5-trimethylcyclohexoxy]isonicotinate Formula: C15H20NO3- MolecularWeight: 262.3242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)OC2=NC=CC(=C2)C(=O)[O-]

Isomeric SMILES

C[C@H]1C[C@@H](CC(C1)(C)C)OC2=NC=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C15H21NO3/c1-10-6-12(9-15(2,3)8-10)19-13-7-11(14(17)18)4-5-16-13/h4-5,7,10,12H,6,8-9H2,1-3H3,(H,17,18)/p-1/t10-,12-/m0/s1