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

Systemtic Name: 2-[2-ethoxy-6-[(E)-2-(5-nitro-2-oxidanidyl-4-oxidanylidene-1H-pyrimidin-6-yl)ethenyl]phenoxy]ethanoate Openeye Name: 2-[2-ethoxy-6-[(E)-2-(5-nitro-2-oxido-4-oxo-1H-pyrimidin-6-yl)vinyl]phenoxy]acetate CAS Name: 2-[2-ethoxy-6-[(E)-2-(5-nitro-2-oxido-4-oxo-1H-pyrimidin-6-yl)ethenyl]phenoxy]acetate IUPAC Name: 2-[2-ethoxy-6-[(E)-2-(5-nitro-2-oxido-4-oxo-1H-pyrimidin-6-yl)ethenyl]phenoxy]acetate Traditional Name: 2-[2-ethoxy-6-[(E)-2-(4-keto-5-nitro-2-oxido-1H-pyrimidin-6-yl)vinyl]phenoxy]acetate Formula: C16H13N3O8-2 MolecularWeight: 375.28972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OCC(=O)[O-])C=CC2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC(=C1OCC(=O)[O-])/C=C/C2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O8/c1-2-26-11-5-3-4-9(14(11)27-8-12(20)21)6-7-10-13(19(24)25)15(22)18-16(23)17-10/h3-7H,2,8H2,1H3,(H,20,21)(H2,17,18,22,23)/p-2/b7-6+