(5E)-4,6-bis(oxidanylidene)-5-[1-(2-pentanoylhydrazinyl)ethylidene]-1-phenyl-pyrimidin-2-olate

Systemtic Name: (5E)-4,6-bis(oxidanylidene)-5-[1-(2-pentanoylhydrazinyl)ethylidene]-1-phenyl-pyrimidin-2-olate Openeye Name: (5E)-4,6-dioxo-5-[1-(2-pentanoylhydrazino)ethylidene]-1-phenyl-pyrimidin-2-olate CAS Name: (5E)-4,6-dioxo-5-[1-(1-oxopentylhydrazo)ethylidene]-1-phenyl-2-pyrimidinolate IUPAC Name: (5E)-4,6-dioxo-5-[1-(2-pentanoylhydrazinyl)ethylidene]-1-phenylpyrimidin-2-olate Traditional Name: (5E)-4,6-diketo-1-phenyl-5-[1-(N'-valerylhydrazino)ethylidene]pyrimidin-2-olate Formula: C17H19N4O4- MolecularWeight: 343.35716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NNC(=C1C(=O)N=C(N(C1=O)C2=CC=CC=C2)[O-])C

Isomeric SMILES

CCCCC(=O)NN/C(=C/1\C(=O)N=C(N(C1=O)C2=CC=CC=C2)[O-])/C

InChI

InChI=1S/C17H20N4O4/c1-3-4-10-13(22)20-19-11(2)14-15(23)18-17(25)21(16(14)24)12-8-6-5-7-9-12/h5-9,19H,3-4,10H2,1-2H3,(H,20,22)(H,18,23,25)/p-1/b14-11+