ethyl 4-[6-(5-bromanylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-(5-bromanylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[6-[(5-bromo-8-quinolinyl)oxy]-5-nitro-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-(5-bromoquinolin-8-yl)oxy-5-nitropyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]piperazine-1-carboxylic acid ethyl ester Formula: C20H19BrN6O5 MolecularWeight: 503.30606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C20H19BrN6O5/c1-2-31-20(28)26-10-8-25(9-11-26)18-17(27(29)30)19(24-12-23-18)32-15-6-5-14(21)13-4-3-7-22-16(13)15/h3-7,12H,2,8-11H2,1H3