5-bromanyl-8-[6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]oxy-quinoline

Systemtic Name: 5-bromanyl-8-[6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]oxy-quinoline Openeye Name: 5-bromo-8-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]oxy-quinoline CAS Name: 5-bromo-8-[[6-(4-chloro-3-methylphenoxy)-5-nitro-4-pyrimidinyl]oxy]quinoline IUPAC Name: 5-bromo-8-[6-(4-chloro-3-methylphenoxy)-5-nitropyrimidin-4-yl]oxyquinoline Traditional Name: 5-bromo-8-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]oxy-quinoline Formula: C20H12BrClN4O4 MolecularWeight: 487.69068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H12BrClN4O4/c1-11-9-12(4-6-15(11)22)29-19-18(26(27)28)20(25-10-24-19)30-16-7-5-14(21)13-3-2-8-23-17(13)16/h2-10H,1H3