4-methoxy-5-nitro-6-[[(4-nitrophenyl)diazenyl]methyl]pyrimidin-2-amine

Systemtic Name: 4-methoxy-5-nitro-6-[[(4-nitrophenyl)diazenyl]methyl]pyrimidin-2-amine Openeye Name: 4-methoxy-5-nitro-6-[(4-nitrophenyl)azomethyl]pyrimidin-2-amine CAS Name: 4-methoxy-5-nitro-6-[(4-nitrophenyl)azomethyl]-2-pyrimidinamine IUPAC Name: 4-methoxy-5-nitro-6-[[(4-nitrophenyl)diazenyl]methyl]pyrimidin-2-amine Traditional Name: [4-methoxy-5-nitro-6-[(4-nitrophenyl)azomethyl]pyrimidin-2-yl]amine Formula: C12H11N7O5 MolecularWeight: 333.25964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1[N+](=O)[O-])CN=NC2=CC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

COC1=NC(=NC(=C1[N+](=O)[O-])CN=NC2=CC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C12H11N7O5/c1-24-11-10(19(22)23)9(15-12(13)16-11)6-14-17-7-2-4-8(5-3-7)18(20)21/h2-5H,6H2,1H3,(H2,13,15,16)