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

Systemtic Name: 5-bromanyl-8-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxy-quinoline Openeye Name: 5-bromo-8-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxy-quinoline CAS Name: 5-bromo-8-[[6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]oxy]quinoline IUPAC Name: 5-bromo-8-[6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-yl]oxyquinoline Traditional Name: 5-bromo-8-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]oxy-quinoline Formula: C18H17BrN6O3 MolecularWeight: 445.26998

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C18H17BrN6O3/c1-23-7-9-24(10-8-23)17-16(25(26)27)18(22-11-21-17)28-14-5-4-13(19)12-3-2-6-20-15(12)14/h2-6,11H,7-10H2,1H3