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

Systemtic Name: ethyl 2-[6-[3-(diethylcarbamoyl)phenoxy]-2-methylsulfonyl-5-nitro-pyrimidin-4-yl]oxyethanoate Openeye Name: ethyl 2-[6-[3-(diethylcarbamoyl)phenoxy]-2-methylsulfonyl-5-nitro-pyrimidin-4-yl]oxyacetate CAS Name: 2-[[6-[3-[diethylamino(oxo)methyl]phenoxy]-2-methylsulfonyl-5-nitro-4-pyrimidinyl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-[3-(diethylcarbamoyl)phenoxy]-2-methylsulfonyl-5-nitropyrimidin-4-yl]oxyacetate Traditional Name: 2-[6-[3-(diethylcarbamoyl)phenoxy]-2-mesyl-5-nitro-pyrimidin-4-yl]oxyacetic acid ethyl ester Formula: C20H24N4O9S MolecularWeight: 496.49096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)OC2=C(C(=NC(=N2)S(=O)(=O)C)OCC(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)OC2=C(C(=NC(=N2)S(=O)(=O)C)OCC(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O9S/c1-5-23(6-2)19(26)13-9-8-10-14(11-13)33-18-16(24(27)28)17(32-12-15(25)31-7-3)21-20(22-18)34(4,29)30/h8-11H,5-7,12H2,1-4H3