(4E)-4-[oxidanyl-(pyrimidin-2-ylamino)methylidene]-1-propyl-quinoline-2,3-dione

Systemtic Name: (4E)-4-[oxidanyl-(pyrimidin-2-ylamino)methylidene]-1-propyl-quinoline-2,3-dione Openeye Name: (4E)-4-[hydroxy-(pyrimidin-2-ylamino)methylene]-1-propyl-quinoline-2,3-dione CAS Name: (4E)-4-[hydroxy-(2-pyrimidinylamino)methylidene]-1-propylquinoline-2,3-dione IUPAC Name: (4E)-4-[hydroxy-(pyrimidin-2-ylamino)methylidene]-1-propylquinoline-2,3-dione Traditional Name: (4E)-4-[hydroxy-(2-pyrimidylamino)methylene]-1-propyl-quinoline-2,3-quinone Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=C(NC3=NC=CC=N3)O)C(=O)C1=O

Isomeric SMILES

CCCN1C2=CC=CC=C2/C(=C(/NC3=NC=CC=N3)\O)/C(=O)C1=O

InChI

InChI=1S/C17H16N4O3/c1-2-10-21-12-7-4-3-6-11(12)13(14(22)16(21)24)15(23)20-17-18-8-5-9-19-17/h3-9,23H,2,10H2,1H3,(H,18,19,20)/b15-13+