5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-1,3-dimethyl-barbituric acid Formula: C14H11BrN2O5 MolecularWeight: 367.15154

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC3=C(C=C2Br)OCO3)C(=O)N(C1=O)C

Isomeric SMILES

CN1C(=O)C(=CC2=CC3=C(C=C2Br)OCO3)C(=O)N(C1=O)C

InChI

InChI=1S/C14H11BrN2O5/c1-16-12(18)8(13(19)17(2)14(16)20)3-7-4-10-11(5-9(7)15)22-6-21-10/h3-5H,6H2,1-2H3