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

Systemtic Name: 6-(4-bromanylphenoxy)-5-nitro-N-(3-nitrophenyl)pyrimidin-4-amine Openeye Name: 6-(4-bromophenoxy)-5-nitro-N-(3-nitrophenyl)pyrimidin-4-amine CAS Name: 6-(4-bromophenoxy)-5-nitro-N-(3-nitrophenyl)-4-pyrimidinamine IUPAC Name: 6-(4-bromophenoxy)-5-nitro-N-(3-nitrophenyl)pyrimidin-4-amine Traditional Name: [6-(4-bromophenoxy)-5-nitro-pyrimidin-4-yl]-(3-nitrophenyl)amine Formula: C16H10BrN5O5 MolecularWeight: 432.1851

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=C(C(=NC=N2)OC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=C(C(=NC=N2)OC3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H10BrN5O5/c17-10-4-6-13(7-5-10)27-16-14(22(25)26)15(18-9-19-16)20-11-2-1-3-12(8-11)21(23)24/h1-9H,(H,18,19,20)