4-[4-[6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-yl]oxyphenyl]cyclohexan-1-one

Systemtic Name: 4-[4-[6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-yl]oxyphenyl]cyclohexan-1-one Openeye Name: 4-[4-[6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-yl]oxyphenyl]cyclohexanone CAS Name: 4-[4-[[6-(2,6-dimethyl-4-morpholinyl)-5-nitro-4-pyrimidinyl]oxy]phenyl]-1-cyclohexanone IUPAC Name: 4-[4-[6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-yl]oxyphenyl]cyclohexan-1-one Traditional Name: 4-[4-[6-(2,6-dimethylmorpholino)-5-nitro-pyrimidin-4-yl]oxyphenyl]cyclohexanone Formula: C22H26N4O5 MolecularWeight: 426.46564

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=C(C(=NC=N2)OC3=CC=C(C=C3)C4CCC(=O)CC4)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)C2=C(C(=NC=N2)OC3=CC=C(C=C3)C4CCC(=O)CC4)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O5/c1-14-11-25(12-15(2)30-14)21-20(26(28)29)22(24-13-23-21)31-19-9-5-17(6-10-19)16-3-7-18(27)8-4-16/h5-6,9-10,13-16H,3-4,7-8,11-12H2,1-2H3