2-[[(2-pyridin-3-ylpyrimidin-4-yl)amino]methylidene]propanedioic acid

Systemtic Name: 2-[[(2-pyridin-3-ylpyrimidin-4-yl)amino]methylidene]propanedioic acid Openeye Name: 2-[[[2-(3-pyridyl)pyrimidin-4-yl]amino]methylene]propanedioic acid CAS Name: 2-[[[2-(3-pyridinyl)-4-pyrimidinyl]amino]methylidene]propanedioic acid IUPAC Name: 2-[[(2-pyridin-3-ylpyrimidin-4-yl)amino]methylidene]propanedioic acid Traditional Name: 2-[[[2-(3-pyridyl)pyrimidin-4-yl]amino]methylene]malonic acid Formula: C13H10N4O4 MolecularWeight: 286.2429

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC=CC(=N2)NC=C(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)C2=NC=CC(=N2)NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C13H10N4O4/c18-12(19)9(13(20)21)7-16-10-3-5-15-11(17-10)8-2-1-4-14-6-8/h1-7H,(H,18,19)(H,20,21)(H,15,16,17)