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

Systemtic Name: tert-butyl 2-[[6-(2-ethanoyl-5-fluoranyl-phenoxy)-5-nitro-pyrimidin-4-yl]-methyl-amino]ethanoate Openeye Name: tert-butyl 2-[[6-(2-acetyl-5-fluoro-phenoxy)-5-nitro-pyrimidin-4-yl]-methyl-amino]acetate CAS Name: 2-[[6-(2-acetyl-5-fluorophenoxy)-5-nitro-4-pyrimidinyl]-methylamino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[6-(2-acetyl-5-fluorophenoxy)-5-nitropyrimidin-4-yl]-methylamino]acetate Traditional Name: 2-[[6-(2-acetyl-5-fluoro-phenoxy)-5-nitro-pyrimidin-4-yl]-methyl-amino]acetic acid tert-butyl ester Formula: C19H21FN4O6 MolecularWeight: 420.391643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21FN4O6/c1-11(25)13-7-6-12(20)8-14(13)29-18-16(24(27)28)17(21-10-22-18)23(5)9-15(26)30-19(2,3)4/h6-8,10H,9H2,1-5H3