4-[6-(4-bromanyl-2-fluoranyl-phenoxy)-5-nitro-pyrimidin-4-yl]-2,6-dimethyl-morpholine

Systemtic Name: 4-[6-(4-bromanyl-2-fluoranyl-phenoxy)-5-nitro-pyrimidin-4-yl]-2,6-dimethyl-morpholine Openeye Name: 4-[6-(4-bromo-2-fluoro-phenoxy)-5-nitro-pyrimidin-4-yl]-2,6-dimethyl-morpholine CAS Name: 4-[6-(4-bromo-2-fluorophenoxy)-5-nitro-4-pyrimidinyl]-2,6-dimethylmorpholine IUPAC Name: 4-[6-(4-bromo-2-fluorophenoxy)-5-nitropyrimidin-4-yl]-2,6-dimethylmorpholine Traditional Name: 4-[6-(4-bromo-2-fluoro-phenoxy)-5-nitro-pyrimidin-4-yl]-2,6-dimethyl-morpholine Formula: C16H16BrFN4O4 MolecularWeight: 427.225043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16BrFN4O4/c1-9-6-21(7-10(2)25-9)15-14(22(23)24)16(20-8-19-15)26-13-4-3-11(17)5-12(13)18/h3-5,8-10H,6-7H2,1-2H3