5-chloranyl-6-[(2S)-4-methylpentan-2-yl]oxy-pyridine-3-carboxylate

Systemtic Name: 5-chloranyl-6-[(2S)-4-methylpentan-2-yl]oxy-pyridine-3-carboxylate Openeye Name: 5-chloro-6-[(1S)-1,3-dimethylbutoxy]pyridine-3-carboxylate CAS Name: 5-chloro-6-[(2S)-4-methylpentan-2-yl]oxy-3-pyridinecarboxylate IUPAC Name: 5-chloro-6-[(2S)-4-methylpentan-2-yl]oxypyridine-3-carboxylate Traditional Name: 5-chloro-6-[(1S)-1,3-dimethylbutoxy]nicotinate Formula: C12H15ClNO3- MolecularWeight: 256.7054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)OC1=C(C=C(C=N1)C(=O)[O-])Cl

Isomeric SMILES

C[C@@H](CC(C)C)OC1=C(C=C(C=N1)C(=O)[O-])Cl

InChI

InChI=1S/C12H16ClNO3/c1-7(2)4-8(3)17-11-10(13)5-9(6-14-11)12(15)16/h5-8H,4H2,1-3H3,(H,15,16)/p-1/t8-/m0/s1