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

Systemtic Name: ethyl 2-[6-[3-(dimethylcarbamoyl)-5-(trifluoromethyl)phenoxy]-2-methylsulfonyl-5-nitro-pyrimidin-4-yl]oxyethanoate Openeye Name: ethyl 2-[6-[3-(dimethylcarbamoyl)-5-(trifluoromethyl)phenoxy]-2-methylsulfonyl-5-nitro-pyrimidin-4-yl]oxyacetate CAS Name: 2-[[6-[3-[dimethylamino(oxo)methyl]-5-(trifluoromethyl)phenoxy]-2-methylsulfonyl-5-nitro-4-pyrimidinyl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-[3-(dimethylcarbamoyl)-5-(trifluoromethyl)phenoxy]-2-methylsulfonyl-5-nitropyrimidin-4-yl]oxyacetate Traditional Name: 2-[6-[3-(dimethylcarbamoyl)-5-(trifluoromethyl)phenoxy]-2-mesyl-5-nitro-pyrimidin-4-yl]oxyacetic acid ethyl ester Formula: C19H19F3N4O9S MolecularWeight: 536.43577

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=NC(=NC(=C1[N+](=O)[O-])OC2=CC(=CC(=C2)C(F)(F)F)C(=O)N(C)C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)COC1=NC(=NC(=C1[N+](=O)[O-])OC2=CC(=CC(=C2)C(F)(F)F)C(=O)N(C)C)S(=O)(=O)C

InChI

InChI=1S/C19H19F3N4O9S/c1-5-33-13(27)9-34-15-14(26(29)30)16(24-18(23-15)36(4,31)32)35-12-7-10(17(28)25(2)3)6-11(8-12)19(20,21)22/h6-8H,5,9H2,1-4H3