6-[(1R,2S)-2-ethylcyclohexyl]oxypyridine-3-carboxylate

Systemtic Name: 6-[(1R,2S)-2-ethylcyclohexyl]oxypyridine-3-carboxylate Openeye Name: 6-[(1R,2S)-2-ethylcyclohexoxy]pyridine-3-carboxylate CAS Name: 6-[(1R,2S)-2-ethylcyclohexyl]oxy-3-pyridinecarboxylate IUPAC Name: 6-[(1R,2S)-2-ethylcyclohexyl]oxypyridine-3-carboxylate Traditional Name: 6-[(1R,2S)-2-ethylcyclohexoxy]nicotinate Formula: C14H18NO3- MolecularWeight: 248.29762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCC1OC2=NC=C(C=C2)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3/c1-2-10-5-3-4-6-12(10)18-13-8-7-11(9-15-13)14(16)17/h7-10,12H,2-6H2,1H3,(H,16,17)/p-1/t10-,12+/m0/s1