6-(4-ethylphenoxy)-N-(4-iodophenyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(4-ethylphenoxy)-N-(4-iodophenyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-ethylphenoxy)-N-(4-iodophenyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-ethylphenoxy)-N-(4-iodophenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-ethylphenoxy)-N-(4-iodophenyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-yl]-(4-iodophenyl)amine Formula: C18H15IN4O3 MolecularWeight: 462.24117

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)I

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)I

InChI

InChI=1S/C18H15IN4O3/c1-2-12-3-9-15(10-4-12)26-18-16(23(24)25)17(20-11-21-18)22-14-7-5-13(19)6-8-14/h3-11H,2H2,1H3,(H,20,21,22)