6-(5-bromanylquinolin-8-yl)oxy-N-(2-methoxyethyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(5-bromanylquinolin-8-yl)oxy-N-(2-methoxyethyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-[(5-bromo-8-quinolyl)oxy]-N-(2-methoxyethyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-[(5-bromo-8-quinolinyl)oxy]-N-(2-methoxyethyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(5-bromoquinolin-8-yl)oxy-N-(2-methoxyethyl)-5-nitropyrimidin-4-amine Traditional Name: [6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]-(2-methoxyethyl)amine Formula: C16H14BrN5O4 MolecularWeight: 420.21746

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C(=NC=N1)OC2=C3C(=C(C=C2)Br)C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C(=NC=N1)OC2=C3C(=C(C=C2)Br)C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H14BrN5O4/c1-25-8-7-19-15-14(22(23)24)16(21-9-20-15)26-12-5-4-11(17)10-3-2-6-18-13(10)12/h2-6,9H,7-8H2,1H3,(H,19,20,21)