5-[(5-bromanyl-3-methoxy-2-prop-2-ynoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(5-bromanyl-3-methoxy-2-prop-2-ynoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(5-bromo-3-methoxy-2-prop-2-ynoxy-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(5-bromo-3-methoxy-2-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(5-bromo-3-methoxy-2-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(5-bromo-3-methoxy-2-propargyloxy-benzylidene)barbituric acid Formula: C15H11BrN2O5 MolecularWeight: 379.16224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)C=C2C(=O)NC(=O)NC2=O)OCC#C

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)C=C2C(=O)NC(=O)NC2=O)OCC#C

InChI

InChI=1S/C15H11BrN2O5/c1-3-4-23-12-8(5-9(16)7-11(12)22-2)6-10-13(19)17-15(21)18-14(10)20/h1,5-7H,4H2,2H3,(H2,17,18,19,20,21)