(5E)-6-(3-nitrophenyl)-5-[oxidanyl(piperazin-1-yl)methylidene]-1,3-diazinane-2,4-dione

Systemtic Name: (5E)-6-(3-nitrophenyl)-5-[oxidanyl(piperazin-1-yl)methylidene]-1,3-diazinane-2,4-dione Openeye Name: (5E)-5-[hydroxy(piperazin-1-yl)methylene]-6-(3-nitrophenyl)hexahydropyrimidine-2,4-dione CAS Name: (5E)-5-[hydroxy(1-piperazinyl)methylidene]-6-(3-nitrophenyl)-1,3-diazinane-2,4-dione IUPAC Name: (5E)-5-[hydroxy(piperazin-1-yl)methylidene]-6-(3-nitrophenyl)-1,3-diazinane-2,4-dione Traditional Name: (5E)-5-[hydroxy(piperazino)methylene]-6-(3-nitrophenyl)-5,6-dihydrouracil Formula: C15H17N5O5 MolecularWeight: 347.32598

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=C2C(NC(=O)NC2=O)C3=CC(=CC=C3)[N+](=O)[O-])O

Isomeric SMILES

C1CN(CCN1)/C(=C\2/C(NC(=O)NC2=O)C3=CC(=CC=C3)[N+](=O)[O-])/O

InChI

InChI=1S/C15H17N5O5/c21-13-11(14(22)19-6-4-16-5-7-19)12(17-15(23)18-13)9-2-1-3-10(8-9)20(24)25/h1-3,8,12,16,22H,4-7H2,(H2,17,18,21,23)/b14-11+