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

Systemtic Name: 5-[[3,5-bis(iodanyl)-4-oxidanyl-phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione Openeye Name: 1-cyclohexyl-5-[(4-hydroxy-3,5-diiodo-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-cyclohexyl-5-[(4-hydroxy-3,5-diiodophenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-cyclohexyl-5-[(4-hydroxy-3,5-diiodophenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-cyclohexyl-5-(4-hydroxy-3,5-diiodo-benzylidene)barbituric acid Formula: C17H16I2N2O4 MolecularWeight: 566.12888

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CC3=CC(=C(C(=C3)I)O)I)C(=O)NC2=O

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(=CC3=CC(=C(C(=C3)I)O)I)C(=O)NC2=O

InChI

InChI=1S/C17H16I2N2O4/c18-12-7-9(8-13(19)14(12)22)6-11-15(23)20-17(25)21(16(11)24)10-4-2-1-3-5-10/h6-8,10,22H,1-5H2,(H,20,23,25)