methyl 3-[6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-yl]oxybenzoate

Systemtic Name: methyl 3-[6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-yl]oxybenzoate Openeye Name: methyl 3-[6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-yl]oxybenzoate CAS Name: 3-[[6-(2,6-dimethyl-4-morpholinyl)-5-nitro-4-pyrimidinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 3-[6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-yl]oxybenzoate Traditional Name: 3-[6-(2,6-dimethylmorpholino)-5-nitro-pyrimidin-4-yl]oxybenzoic acid methyl ester Formula: C18H20N4O6 MolecularWeight: 388.3746

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=C(C(=NC=N2)OC3=CC=CC(=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)C2=C(C(=NC=N2)OC3=CC=CC(=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O6/c1-11-8-21(9-12(2)27-11)16-15(22(24)25)17(20-10-19-16)28-14-6-4-5-13(7-14)18(23)26-3/h4-7,10-12H,8-9H2,1-3H3