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

Systemtic Name: methyl 2-[4-[(3-bromanyl-5-nitro-4-oxidanyl-phenyl)methylidene]-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoate Openeye Name: methyl 2-[4-[(3-bromo-4-hydroxy-5-nitro-phenyl)methylene]-2,5-dioxo-imidazolidin-1-yl]acetate CAS Name: 2-[4-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-2,5-dioxo-1-imidazolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-2,5-dioxoimidazolidin-1-yl]acetate Traditional Name: 2-[4-(3-bromo-4-hydroxy-5-nitro-benzylidene)-2,5-diketo-imidazolidin-1-yl]acetic acid methyl ester Formula: C13H10BrN3O7 MolecularWeight: 400.1384

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C(=CC2=CC(=C(C(=C2)Br)O)[N+](=O)[O-])NC1=O

Isomeric SMILES

COC(=O)CN1C(=O)C(=CC2=CC(=C(C(=C2)Br)O)[N+](=O)[O-])NC1=O

InChI

InChI=1S/C13H10BrN3O7/c1-24-10(18)5-16-12(20)8(15-13(16)21)3-6-2-7(14)11(19)9(4-6)17(22)23/h2-4,19H,5H2,1H3,(H,15,21)