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

Systemtic Name: 5-bromanyl-8-[6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-yl]oxy-quinoline Openeye Name: 5-bromo-8-[6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-yl]oxy-quinoline CAS Name: 5-bromo-8-[[6-(4-ethylphenoxy)-5-nitro-4-pyrimidinyl]oxy]quinoline IUPAC Name: 5-bromo-8-[6-(4-ethylphenoxy)-5-nitropyrimidin-4-yl]oxyquinoline Traditional Name: 5-bromo-8-[6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-yl]oxy-quinoline Formula: C21H15BrN4O4 MolecularWeight: 467.2722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C21H15BrN4O4/c1-2-13-5-7-14(8-6-13)29-20-19(26(27)28)21(25-12-24-20)30-17-10-9-16(22)15-4-3-11-23-18(15)17/h3-12H,2H2,1H3