ethyl 2-[2-(5-cyano-2-phenoxy-phenoxy)-6-[3-(dimethylcarbamoyl)-5-methoxy-phenoxy]-5-nitro-pyrimidin-4-yl]oxyethanoate

Systemtic Name: ethyl 2-[2-(5-cyano-2-phenoxy-phenoxy)-6-[3-(dimethylcarbamoyl)-5-methoxy-phenoxy]-5-nitro-pyrimidin-4-yl]oxyethanoate Openeye Name: ethyl 2-[2-(5-cyano-2-phenoxy-phenoxy)-6-[3-(dimethylcarbamoyl)-5-methoxy-phenoxy]-5-nitro-pyrimidin-4-yl]oxyacetate CAS Name: 2-[[2-(5-cyano-2-phenoxyphenoxy)-6-[3-[dimethylamino(oxo)methyl]-5-methoxyphenoxy]-5-nitro-4-pyrimidinyl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(5-cyano-2-phenoxyphenoxy)-6-[3-(dimethylcarbamoyl)-5-methoxyphenoxy]-5-nitropyrimidin-4-yl]oxyacetate Traditional Name: 2-[2-(5-cyano-2-phenoxy-phenoxy)-6-[3-(dimethylcarbamoyl)-5-methoxy-phenoxy]-5-nitro-pyrimidin-4-yl]oxyacetic acid ethyl ester Formula: C31H27N5O10 MolecularWeight: 629.57358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=NC(=NC(=C1[N+](=O)[O-])OC2=CC(=CC(=C2)C(=O)N(C)C)OC)OC3=C(C=CC(=C3)C#N)OC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)COC1=NC(=NC(=C1[N+](=O)[O-])OC2=CC(=CC(=C2)C(=O)N(C)C)OC)OC3=C(C=CC(=C3)C#N)OC4=CC=CC=C4

InChI

InChI=1S/C31H27N5O10/c1-5-42-26(37)18-43-28-27(36(39)40)29(45-23-15-20(30(38)35(2)3)14-22(16-23)41-4)34-31(33-28)46-25-13-19(17-32)11-12-24(25)44-21-9-7-6-8-10-21/h6-16H,5,18H2,1-4H3