methyl 2-[2-methoxy-6-[(E)-2-(5-nitro-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)ethenyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[2-methoxy-6-[(E)-2-(5-nitro-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)ethenyl]phenoxy]ethanoate Openeye Name: methyl 2-[2-[(E)-2-(4-hydroxy-5-nitro-6-oxo-1H-pyrimidin-2-yl)vinyl]-6-methoxy-phenoxy]acetate CAS Name: 2-[2-[(E)-2-(4-hydroxy-5-nitro-6-oxo-1H-pyrimidin-2-yl)ethenyl]-6-methoxyphenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(E)-2-(4-hydroxy-5-nitro-6-oxo-1H-pyrimidin-2-yl)ethenyl]-6-methoxyphenoxy]acetate Traditional Name: 2-[2-[(E)-2-(4-hydroxy-6-keto-5-nitro-1H-pyrimidin-2-yl)vinyl]-6-methoxy-phenoxy]acetic acid methyl ester Formula: C16H15N3O8 MolecularWeight: 377.3056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC(=O)OC)C=CC2=NC(=C(C(=O)N2)[N+](=O)[O-])O

Isomeric SMILES

COC1=CC=CC(=C1OCC(=O)OC)/C=C/C2=NC(=C(C(=O)N2)[N+](=O)[O-])O

InChI

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