3-chloranyl-6-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]pyridine-2-carboxylate

Systemtic Name: 3-chloranyl-6-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]pyridine-2-carboxylate Openeye Name: 3-chloro-6-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]pyridine-2-carboxylate CAS Name: 3-chloro-6-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]-2-pyridinecarboxylate IUPAC Name: 3-chloro-6-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]pyridine-2-carboxylate Traditional Name: 3-chloro-6-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]picolinate Formula: C14H18ClN2O2- MolecularWeight: 281.75792

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC2=NC(=C(C=C2)Cl)C(=O)[O-]

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)NC2=NC(=C(C=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C14H19ClN2O2/c1-8-4-3-5-11(9(8)2)16-12-7-6-10(15)13(17-12)14(18)19/h6-9,11H,3-5H2,1-2H3,(H,16,17)(H,18,19)/p-1/t8-,9+,11-/m0/s1