8-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]oxyquinoline

Systemtic Name: 8-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]oxyquinoline Openeye Name: 8-[5-nitro-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidin-4-yl]oxyquinoline CAS Name: 8-[[5-nitro-6-[4-(2-pyridinyl)-1-piperazinyl]-4-pyrimidinyl]oxy]quinoline IUPAC Name: 8-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]oxyquinoline Traditional Name: 8-[5-nitro-6-[4-(2-pyridyl)piperazino]pyrimidin-4-yl]oxyquinoline Formula: C22H19N7O3 MolecularWeight: 429.43136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C3=C(C(=NC=N3)OC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C3=C(C(=NC=N3)OC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H19N7O3/c30-29(31)20-21(28-13-11-27(12-14-28)18-8-1-2-9-23-18)25-15-26-22(20)32-17-7-3-5-16-6-4-10-24-19(16)17/h1-10,15H,11-14H2