2-[(2S)-octan-2-yl]oxypyridine-4-carboxylate

Systemtic Name: 2-[(2S)-octan-2-yl]oxypyridine-4-carboxylate Openeye Name: 2-[(1S)-1-methylheptoxy]pyridine-4-carboxylate CAS Name: 2-[(2S)-octan-2-yl]oxy-4-pyridinecarboxylate IUPAC Name: 2-[(2S)-octan-2-yl]oxypyridine-4-carboxylate Traditional Name: 2-[(1S)-1-methylheptoxy]isonicotinate Formula: C14H20NO3- MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=NC=CC(=C1)C(=O)[O-]

Isomeric SMILES

CCCCCC[C@H](C)OC1=NC=CC(=C1)C(=O)[O-]

InChI

InChI=1S/C14H21NO3/c1-3-4-5-6-7-11(2)18-13-10-12(14(16)17)8-9-15-13/h8-11H,3-7H2,1-2H3,(H,16,17)/p-1/t11-/m0/s1