2-(oxan-2-yloxy)-2-(pyridin-4-ylmethyl)propanedioic acid

Systemtic Name: 2-(oxan-2-yloxy)-2-(pyridin-4-ylmethyl)propanedioic acid Openeye Name: 2-(4-pyridylmethyl)-2-tetrahydropyran-2-yloxy-propanedioic acid CAS Name: 2-(2-oxanyloxy)-2-(pyridin-4-ylmethyl)propanedioic acid IUPAC Name: 2-(oxan-2-yloxy)-2-(pyridin-4-ylmethyl)propanedioic acid Traditional Name: 2-(4-pyridylmethyl)-2-tetrahydropyran-2-yloxy-malonic acid Formula: C14H17NO6 MolecularWeight: 295.28788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OC(CC2=CC=NC=C2)(C(=O)O)C(=O)O

Isomeric SMILES

C1CCOC(C1)OC(CC2=CC=NC=C2)(C(=O)O)C(=O)O

InChI

InChI=1S/C14H17NO6/c16-12(17)14(13(18)19,9-10-4-6-15-7-5-10)21-11-3-1-2-8-20-11/h4-7,11H,1-3,8-9H2,(H,16,17)(H,18,19)