(E)-2-methyl-4-oxidanylidene-4-(pyrimidin-2-ylamino)but-2-enoic acid

Systemtic Name: (E)-2-methyl-4-oxidanylidene-4-(pyrimidin-2-ylamino)but-2-enoic acid Openeye Name: (E)-2-methyl-4-oxo-4-(pyrimidin-2-ylamino)but-2-enoic acid CAS Name: (E)-2-methyl-4-oxo-4-(2-pyrimidinylamino)-2-butenoic acid IUPAC Name: (E)-2-methyl-4-oxo-4-(pyrimidin-2-ylamino)but-2-enoic acid Traditional Name: (E)-4-keto-2-methyl-4-(2-pyrimidylamino)but-2-enoic acid Formula: C9H9N3O3 MolecularWeight: 207.18606

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=NC=CC=N1)C(=O)O

Isomeric SMILES

C/C(=C\C(=O)NC1=NC=CC=N1)/C(=O)O

InChI

InChI=1S/C9H9N3O3/c1-6(8(14)15)5-7(13)12-9-10-3-2-4-11-9/h2-5H,1H3,(H,14,15)(H,10,11,12,13)/b6-5+