6-(4-chloranyl-3,5-dimethyl-phenoxy)-N-(3-chloranyl-4-fluoranyl-phenyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(4-chloranyl-3,5-dimethyl-phenoxy)-N-(3-chloranyl-4-fluoranyl-phenyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-chloro-3,5-dimethyl-phenoxy)-N-(3-chloro-4-fluoro-phenyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-chloro-3,5-dimethylphenoxy)-N-(3-chloro-4-fluorophenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-chloro-3,5-dimethylphenoxy)-N-(3-chloro-4-fluorophenyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-pyrimidin-4-yl]-(3-chloro-4-fluoro-phenyl)amine Formula: C18H13Cl2FN4O3 MolecularWeight: 423.225223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H13Cl2FN4O3/c1-9-5-12(6-10(2)15(9)20)28-18-16(25(26)27)17(22-8-23-18)24-11-3-4-14(21)13(19)7-11/h3-8H,1-2H3,(H,22,23,24)