N4-[(E)-(2-iodanylphenyl)methylideneamino]-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-[(E)-(2-iodanylphenyl)methylideneamino]-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-[(E)-(2-iodophenyl)methyleneamino]-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[(E)-(2-iodophenyl)methylideneamino]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-[(E)-(2-iodophenyl)methylideneamino]-5-nitropyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-[(E)-(2-iodobenzylidene)amino]amine Formula: C11H9IN6O2 MolecularWeight: 384.13263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NNC2=NC=NC(=C2[N+](=O)[O-])N)I

Isomeric SMILES

C1=CC=C(C(=C1)/C=N/NC2=NC=NC(=C2[N+](=O)[O-])N)I

InChI

InChI=1S/C11H9IN6O2/c12-8-4-2-1-3-7(8)5-16-17-11-9(18(19)20)10(13)14-6-15-11/h1-6H,(H3,13,14,15,17)/b16-5+