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

Systemtic Name: methyl 2-[4-[(3-nitro-4-oxidanyl-phenyl)methylidene]-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoate Openeye Name: methyl 2-[4-[(4-hydroxy-3-nitro-phenyl)methylene]-2,5-dioxo-imidazolidin-1-yl]acetate CAS Name: 2-[4-[(4-hydroxy-3-nitrophenyl)methylidene]-2,5-dioxo-1-imidazolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(4-hydroxy-3-nitrophenyl)methylidene]-2,5-dioxoimidazolidin-1-yl]acetate Traditional Name: 2-[4-(4-hydroxy-3-nitro-benzylidene)-2,5-diketo-imidazolidin-1-yl]acetic acid methyl ester Formula: C13H11N3O7 MolecularWeight: 321.24234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O7/c1-23-11(18)6-15-12(19)8(14-13(15)20)4-7-2-3-10(17)9(5-7)16(21)22/h2-5,17H,6H2,1H3,(H,14,20)