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

Systemtic Name: 2-methyl-8-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxy-quinoline Openeye Name: 2-methyl-8-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxy-quinoline CAS Name: 2-methyl-8-[[6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]oxy]quinoline IUPAC Name: 2-methyl-8-[6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-yl]oxyquinoline Traditional Name: 2-methyl-8-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]oxy-quinoline Formula: C19H20N6O3 MolecularWeight: 380.4005

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])N4CCN(CC4)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])N4CCN(CC4)C)C=C1

InChI

InChI=1S/C19H20N6O3/c1-13-6-7-14-4-3-5-15(16(14)22-13)28-19-17(25(26)27)18(20-12-21-19)24-10-8-23(2)9-11-24/h3-7,12H,8-11H2,1-2H3