4-(pyridin-3-ylmethylamino)oxane-4-carboxylic acid

Systemtic Name: 4-(pyridin-3-ylmethylamino)oxane-4-carboxylic acid Openeye Name: 4-(3-pyridylmethylamino)tetrahydropyran-4-carboxylic acid CAS Name: 4-(3-pyridinylmethylamino)-4-oxanecarboxylic acid IUPAC Name: 4-(pyridin-3-ylmethylamino)oxane-4-carboxylic acid Traditional Name: 4-(3-pyridylmethylamino)tetrahydropyran-4-carboxylic acid Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C(=O)O)NCC2=CN=CC=C2

Isomeric SMILES

C1COCCC1(C(=O)O)NCC2=CN=CC=C2

InChI

InChI=1S/C12H16N2O3/c15-11(16)12(3-6-17-7-4-12)14-9-10-2-1-5-13-8-10/h1-2,5,8,14H,3-4,6-7,9H2,(H,15,16)