5-[(3-chloranyl-4-oxidanyl-phenyl)methylidene]-1-(3-nitrophenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(3-chloranyl-4-oxidanyl-phenyl)methylidene]-1-(3-nitrophenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-chloro-4-hydroxy-phenyl)methylene]-1-(3-nitrophenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(3-chloro-4-hydroxyphenyl)methylidene]-1-(3-nitrophenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(3-chloro-4-hydroxyphenyl)methylidene]-1-(3-nitrophenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-chloro-4-hydroxy-benzylidene)-1-(3-nitrophenyl)barbituric acid Formula: C17H10ClN3O6 MolecularWeight: 387.7308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C(=CC3=CC(=C(C=C3)O)Cl)C(=O)NC2=O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C(=CC3=CC(=C(C=C3)O)Cl)C(=O)NC2=O

InChI

InChI=1S/C17H10ClN3O6/c18-13-7-9(4-5-14(13)22)6-12-15(23)19-17(25)20(16(12)24)10-2-1-3-11(8-10)21(26)27/h1-8,22H,(H,19,23,25)