ethanedioic acid; 5-pyridin-3-yl-3-azabicyclo[2.2.2]octane

Systemtic Name: ethanedioic acid; 5-pyridin-3-yl-3-azabicyclo[2.2.2]octane Openeye Name: oxalic acid; 5-(3-pyridyl)-3-azabicyclo[2.2.2]octane CAS Name: oxalic acid; 5-(3-pyridinyl)-3-azabicyclo[2.2.2]octane IUPAC Name: oxalic acid; 5-pyridin-3-yl-3-azabicyclo[2.2.2]octane Traditional Name: oxalic acid; 5-(3-pyridyl)-3-azabicyclo[2.2.2]octane Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(CC1CN2)C3=CN=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC2C(CC1CN2)C3=CN=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H16N2.C2H2O4/c1-2-10(8-13-5-1)11-6-9-3-4-12(11)14-7-9;3-1(4)2(5)6/h1-2,5,8-9,11-12,14H,3-4,6-7H2;(H,3,4)(H,5,6)