5-[(3-ethoxy-5-iodanyl-4-phenylmethoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(3-ethoxy-5-iodanyl-4-phenylmethoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4-benzyloxy-3-ethoxy-5-iodo-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(3-ethoxy-5-iodo-4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(3-ethoxy-5-iodo-4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(4-benzoxy-3-ethoxy-5-iodo-benzylidene)barbituric acid Formula: C20H17IN2O5 MolecularWeight: 492.26385

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)NC2=O)I)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)NC2=O)I)OCC3=CC=CC=C3

InChI

InChI=1S/C20H17IN2O5/c1-2-27-16-10-13(8-14-18(24)22-20(26)23-19(14)25)9-15(21)17(16)28-11-12-6-4-3-5-7-12/h3-10H,2,11H2,1H3,(H2,22,23,24,25,26)