5-bromanyl-8-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]oxy-quinoline

Systemtic Name: 5-bromanyl-8-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]oxy-quinoline Openeye Name: 5-bromo-8-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]oxy-quinoline CAS Name: 5-bromo-8-[[5-nitro-6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]oxy]quinoline IUPAC Name: 5-bromo-8-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]oxyquinoline Traditional Name: 5-bromo-8-[5-nitro-6-(4-phenylpiperazino)pyrimidin-4-yl]oxy-quinoline Formula: C23H19BrN6O3 MolecularWeight: 507.33936

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=NC=N3)OC4=C5C(=C(C=C4)Br)C=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=NC=N3)OC4=C5C(=C(C=C4)Br)C=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C23H19BrN6O3/c24-18-8-9-19(20-17(18)7-4-10-25-20)33-23-21(30(31)32)22(26-15-27-23)29-13-11-28(12-14-29)16-5-2-1-3-6-16/h1-10,15H,11-14H2