1-(furan-2-ylmethyl)-5-[(3-iodanyl-4-oxidanyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(furan-2-ylmethyl)-5-[(3-iodanyl-4-oxidanyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(2-furylmethyl)-5-[(4-hydroxy-3-iodo-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(2-furanylmethyl)-5-[(4-hydroxy-3-iodophenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(furan-2-ylmethyl)-5-[(4-hydroxy-3-iodophenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(2-furfuryl)-5-(4-hydroxy-3-iodo-benzylidene)barbituric acid Formula: C16H11IN2O5 MolecularWeight: 438.17341

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=O)C(=CC3=CC(=C(C=C3)O)I)C(=O)NC2=O

Isomeric SMILES

C1=COC(=C1)CN2C(=O)C(=CC3=CC(=C(C=C3)O)I)C(=O)NC2=O

InChI

InChI=1S/C16H11IN2O5/c17-12-7-9(3-4-13(12)20)6-11-14(21)18-16(23)19(15(11)22)8-10-2-1-5-24-10/h1-7,20H,8H2,(H,18,21,23)