(4,5-dimethoxy-2-nitro-phenyl)-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)-[4-(6-morpholinopyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: (4,5-dimethoxy-2-nitrophenyl)-[4-[6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: (4,5-dimethoxy-2-nitro-phenyl)-[4-(6-morpholinopyrimidin-4-yl)piperazino]methanone Formula: C21H26N6O6 MolecularWeight: 458.46774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4)[N+](=O)[O-])OC

InChI

InChI=1S/C21H26N6O6/c1-31-17-11-15(16(27(29)30)12-18(17)32-2)21(28)26-5-3-24(4-6-26)19-13-20(23-14-22-19)25-7-9-33-10-8-25/h11-14H,3-10H2,1-2H3