methyl 2-[4-[(3-iodanyl-5-nitro-2-oxidanyl-phenyl)methylidene]-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-[(3-iodanyl-5-nitro-2-oxidanyl-phenyl)methylidene]-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoate Openeye Name: methyl 2-[4-[(2-hydroxy-3-iodo-5-nitro-phenyl)methylene]-2,5-dioxo-imidazolidin-1-yl]acetate CAS Name: 2-[4-[(2-hydroxy-3-iodo-5-nitrophenyl)methylidene]-2,5-dioxo-1-imidazolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(2-hydroxy-3-iodo-5-nitrophenyl)methylidene]-2,5-dioxoimidazolidin-1-yl]acetate Traditional Name: 2-[4-(2-hydroxy-3-iodo-5-nitro-benzylidene)-2,5-diketo-imidazolidin-1-yl]acetic acid methyl ester Formula: C13H10IN3O7 MolecularWeight: 447.13887

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C(=CC2=CC(=CC(=C2O)I)[N+](=O)[O-])NC1=O

Isomeric SMILES

COC(=O)CN1C(=O)C(=CC2=CC(=CC(=C2O)I)[N+](=O)[O-])NC1=O

InChI

InChI=1S/C13H10IN3O7/c1-24-10(18)5-16-12(20)9(15-13(16)21)3-6-2-7(17(22)23)4-8(14)11(6)19/h2-4,19H,5H2,1H3,(H,15,21)