6-(1-azabicyclo[2.2.2]octan-3-ylamino)-5-chloranyl-pyridine-3-carboxylic acid

Systemtic Name: 6-(1-azabicyclo[2.2.2]octan-3-ylamino)-5-chloranyl-pyridine-3-carboxylic acid Openeye Name: 5-chloro-6-(quinuclidin-3-ylamino)pyridine-3-carboxylic acid CAS Name: 6-(1-azabicyclo[2.2.2]octan-3-ylamino)-5-chloro-3-pyridinecarboxylic acid IUPAC Name: 6-(1-azabicyclo[2.2.2]octan-3-ylamino)-5-chloropyridine-3-carboxylic acid Traditional Name: 5-chloro-6-(quinuclidin-3-ylamino)nicotinic acid Formula: C13H16ClN3O2 MolecularWeight: 281.73804

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC3=C(C=C(C=N3)C(=O)O)Cl

Isomeric SMILES

C1CN2CCC1C(C2)NC3=C(C=C(C=N3)C(=O)O)Cl

InChI

InChI=1S/C13H16ClN3O2/c14-10-5-9(13(18)19)6-15-12(10)16-11-7-17-3-1-8(11)2-4-17/h5-6,8,11H,1-4,7H2,(H,15,16)(H,18,19)