2-[(1R,2S)-2-methylcyclohexyl]oxypyridine-4-carboxylate

Systemtic Name: 2-[(1R,2S)-2-methylcyclohexyl]oxypyridine-4-carboxylate Openeye Name: 2-[(1R,2S)-2-methylcyclohexoxy]pyridine-4-carboxylate CAS Name: 2-[(1R,2S)-2-methylcyclohexyl]oxy-4-pyridinecarboxylate IUPAC Name: 2-[(1R,2S)-2-methylcyclohexyl]oxypyridine-4-carboxylate Traditional Name: 2-[(1R,2S)-2-methylcyclohexoxy]isonicotinate Formula: C13H16NO3- MolecularWeight: 234.27104

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1OC2=NC=CC(=C2)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3/c1-9-4-2-3-5-11(9)17-12-8-10(13(15)16)6-7-14-12/h6-9,11H,2-5H2,1H3,(H,15,16)/p-1/t9-,11+/m0/s1