6-(4-bromanylphenoxy)-N-(3-morpholin-4-ylpropyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(4-bromanylphenoxy)-N-(3-morpholin-4-ylpropyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-bromophenoxy)-N-(3-morpholinopropyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-bromophenoxy)-N-[3-(4-morpholinyl)propyl]-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-bromophenoxy)-N-(3-morpholin-4-ylpropyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-bromophenoxy)-5-nitro-pyrimidin-4-yl]-(3-morpholinopropyl)amine Formula: C17H20BrN5O4 MolecularWeight: 438.2758

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=C(C(=NC=N2)OC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCCNC2=C(C(=NC=N2)OC3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H20BrN5O4/c18-13-2-4-14(5-3-13)27-17-15(23(24)25)16(20-12-21-17)19-6-1-7-22-8-10-26-11-9-22/h2-5,12H,1,6-11H2,(H,19,20,21)