6-(5-bromanylquinolin-8-yl)oxy-N-(3-methoxypropyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(5-bromanylquinolin-8-yl)oxy-N-(3-methoxypropyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-[(5-bromo-8-quinolyl)oxy]-N-(3-methoxypropyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-[(5-bromo-8-quinolinyl)oxy]-N-(3-methoxypropyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(5-bromoquinolin-8-yl)oxy-N-(3-methoxypropyl)-5-nitropyrimidin-4-amine Traditional Name: [6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]-(3-methoxypropyl)amine Formula: C17H16BrN5O4 MolecularWeight: 434.24404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=C(C(=NC=N1)OC2=C3C(=C(C=C2)Br)C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

COCCCNC1=C(C(=NC=N1)OC2=C3C(=C(C=C2)Br)C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H16BrN5O4/c1-26-9-3-8-20-16-15(23(24)25)17(22-10-21-16)27-13-6-5-12(18)11-4-2-7-19-14(11)13/h2,4-7,10H,3,8-9H2,1H3,(H,20,21,22)