ethyl 4-[4-(5-cyano-2-methyl-phenoxy)-6-(2-ethoxy-2-oxidanylidene-ethoxy)-5-nitro-pyrimidin-2-yl]oxybenzoate

Systemtic Name: ethyl 4-[4-(5-cyano-2-methyl-phenoxy)-6-(2-ethoxy-2-oxidanylidene-ethoxy)-5-nitro-pyrimidin-2-yl]oxybenzoate Openeye Name: ethyl 4-[4-(5-cyano-2-methyl-phenoxy)-6-(2-ethoxy-2-oxo-ethoxy)-5-nitro-pyrimidin-2-yl]oxybenzoate CAS Name: 4-[[4-(5-cyano-2-methylphenoxy)-6-(2-ethoxy-2-oxoethoxy)-5-nitro-2-pyrimidinyl]oxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(5-cyano-2-methylphenoxy)-6-(2-ethoxy-2-oxoethoxy)-5-nitropyrimidin-2-yl]oxybenzoate Traditional Name: 4-[4-(5-cyano-2-methyl-phenoxy)-6-(2-ethoxy-2-keto-ethoxy)-5-nitro-pyrimidin-2-yl]oxybenzoic acid ethyl ester Formula: C25H22N4O9 MolecularWeight: 522.46358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=NC(=NC(=C1[N+](=O)[O-])OC2=C(C=CC(=C2)C#N)C)OC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)COC1=NC(=NC(=C1[N+](=O)[O-])OC2=C(C=CC(=C2)C#N)C)OC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C25H22N4O9/c1-4-34-20(30)14-36-22-21(29(32)33)23(38-19-12-16(13-26)7-6-15(19)3)28-25(27-22)37-18-10-8-17(9-11-18)24(31)35-5-2/h6-12H,4-5,14H2,1-3H3