tert-butyl 2-[[6-(4-ethanoyl-2,6-dimethoxy-phenoxy)-5-nitro-pyrimidin-4-yl]-methyl-amino]ethanoate

Systemtic Name: tert-butyl 2-[[6-(4-ethanoyl-2,6-dimethoxy-phenoxy)-5-nitro-pyrimidin-4-yl]-methyl-amino]ethanoate Openeye Name: tert-butyl 2-[[6-(4-acetyl-2,6-dimethoxy-phenoxy)-5-nitro-pyrimidin-4-yl]-methyl-amino]acetate CAS Name: 2-[[6-(4-acetyl-2,6-dimethoxyphenoxy)-5-nitro-4-pyrimidinyl]-methylamino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[6-(4-acetyl-2,6-dimethoxyphenoxy)-5-nitropyrimidin-4-yl]-methylamino]acetate Traditional Name: 2-[[6-(4-acetyl-2,6-dimethoxy-phenoxy)-5-nitro-pyrimidin-4-yl]-methyl-amino]acetic acid tert-butyl ester Formula: C21H26N4O8 MolecularWeight: 462.45314

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C(=C1)OC)OC2=NC=NC(=C2[N+](=O)[O-])N(C)CC(=O)OC(C)(C)C)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C(=C1)OC)OC2=NC=NC(=C2[N+](=O)[O-])N(C)CC(=O)OC(C)(C)C)OC

InChI

InChI=1S/C21H26N4O8/c1-12(26)13-8-14(30-6)18(15(9-13)31-7)32-20-17(25(28)29)19(22-11-23-20)24(5)10-16(27)33-21(2,3)4/h8-9,11H,10H2,1-7H3