2-[2-methoxy-4-[(Z)-2-(5-nitro-2-oxidanidyl-4-oxidanylidene-1H-pyrimidin-6-yl)ethenyl]phenoxy]ethanoate

Systemtic Name: 2-[2-methoxy-4-[(Z)-2-(5-nitro-2-oxidanidyl-4-oxidanylidene-1H-pyrimidin-6-yl)ethenyl]phenoxy]ethanoate Openeye Name: 2-[2-methoxy-4-[(Z)-2-(5-nitro-2-oxido-4-oxo-1H-pyrimidin-6-yl)vinyl]phenoxy]acetate CAS Name: 2-[2-methoxy-4-[(Z)-2-(5-nitro-2-oxido-4-oxo-1H-pyrimidin-6-yl)ethenyl]phenoxy]acetate IUPAC Name: 2-[2-methoxy-4-[(Z)-2-(5-nitro-2-oxido-4-oxo-1H-pyrimidin-6-yl)ethenyl]phenoxy]acetate Traditional Name: 2-[4-[(Z)-2-(4-keto-5-nitro-2-oxido-1H-pyrimidin-6-yl)vinyl]-2-methoxy-phenoxy]acetate Formula: C15H11N3O8-2 MolecularWeight: 361.26314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-])OCC(=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C\C2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-])OCC(=O)[O-]

InChI

InChI=1S/C15H13N3O8/c1-25-11-6-8(3-5-10(11)26-7-12(19)20)2-4-9-13(18(23)24)14(21)17-15(22)16-9/h2-6H,7H2,1H3,(H,19,20)(H2,16,17,21,22)/p-2/b4-2-