2-(4-iodanyl-2,6-dimethyl-phenoxy)-N-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]amino]ethanamide

Systemtic Name: 2-(4-iodanyl-2,6-dimethyl-phenoxy)-N-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]amino]ethanamide Openeye Name: 2-(4-iodo-2,6-dimethyl-phenoxy)-N-[(2,4,6-trioxohexahydropyrimidin-5-ylidene)amino]acetamide CAS Name: 2-(4-iodo-2,6-dimethylphenoxy)-N-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)amino]acetamide IUPAC Name: 2-(4-iodo-2,6-dimethylphenoxy)-N-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)amino]acetamide Traditional Name: 2-(4-iodo-2,6-dimethyl-phenoxy)-N-[(2,4,6-triketohexahydropyrimidin-5-ylidene)amino]acetamide Formula: C14H13IN4O5 MolecularWeight: 444.18129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NN=C2C(=O)NC(=O)NC2=O)C)I

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NN=C2C(=O)NC(=O)NC2=O)C)I

InChI

InChI=1S/C14H13IN4O5/c1-6-3-8(15)4-7(2)11(6)24-5-9(20)18-19-10-12(21)16-14(23)17-13(10)22/h3-4H,5H2,1-2H3,(H,18,20)(H2,16,17,21,22,23)