6-chloranyl-N-[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]-2-methoxy-pyrimidin-4-amine

Systemtic Name: 6-chloranyl-N-[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]-2-methoxy-pyrimidin-4-amine Openeye Name: 6-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-2-methoxy-pyrimidin-4-amine CAS Name: 6-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-2-methoxy-4-pyrimidinamine IUPAC Name: 6-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-2-methoxypyrimidin-4-amine Traditional Name: [3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-(6-chloro-2-methoxy-pyrimidin-4-yl)amine Formula: C12H6Cl2F3N5O5 MolecularWeight: 428.10775

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=CC(=N1)Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=NC(=CC(=N1)Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H6Cl2F3N5O5/c1-27-11-18-6(13)3-7(20-11)19-9-5(21(23)24)2-4(12(15,16)17)8(14)10(9)22(25)26/h2-3H,1H3,(H,18,19,20)