(4,5-dimethoxy-2-nitro-phenyl)-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]methanone

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]methanone Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]methanone CAS Name: (4,5-dimethoxy-2-nitrophenyl)-[4-(6-propoxy-3-pyridazinyl)-1-piperazinyl]methanone IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]methanone Traditional Name: (4,5-dimethoxy-2-nitro-phenyl)-[4-(6-propoxypyridazin-3-yl)piperazino]methanone Formula: C20H25N5O6 MolecularWeight: 431.4424

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CCCOC1=NN=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H25N5O6/c1-4-11-31-19-6-5-18(21-22-19)23-7-9-24(10-8-23)20(26)14-12-16(29-2)17(30-3)13-15(14)25(27)28/h5-6,12-13H,4,7-11H2,1-3H3