N-[2,5-bis(fluoranyl)phenyl]-6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[2,5-bis(fluoranyl)phenyl]-6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-chloro-3-methyl-phenoxy)-N-(2,5-difluorophenyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-chloro-3-methylphenoxy)-N-(2,5-difluorophenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-chloro-3-methylphenoxy)-N-(2,5-difluorophenyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-(2,5-difluorophenyl)amine Formula: C17H11ClF2N4O3 MolecularWeight: 392.744046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=CC(=C3)F)F)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=CC(=C3)F)F)Cl

InChI

InChI=1S/C17H11ClF2N4O3/c1-9-6-11(3-4-12(9)18)27-17-15(24(25)26)16(21-8-22-17)23-14-7-10(19)2-5-13(14)20/h2-8H,1H3,(H,21,22,23)