[2,6-bis(chloranyl)-4-nitro-phenyl] 1-methyl-5-(trifluoromethyl)-2H-pyrazine-3-carboxylate

Systemtic Name: [2,6-bis(chloranyl)-4-nitro-phenyl] 1-methyl-5-(trifluoromethyl)-2H-pyrazine-3-carboxylate Openeye Name: (2,6-dichloro-4-nitro-phenyl) 1-methyl-5-(trifluoromethyl)-2H-pyrazine-3-carboxylate CAS Name: 1-methyl-5-(trifluoromethyl)-2H-pyrazine-3-carboxylic acid (2,6-dichloro-4-nitrophenyl) ester IUPAC Name: (2,6-dichloro-4-nitrophenyl) 1-methyl-5-(trifluoromethyl)-2H-pyrazine-3-carboxylate Traditional Name: 1-methyl-5-(trifluoromethyl)-2H-pyrazine-3-carboxylic acid (2,6-dichloro-4-nitro-phenyl) ester Formula: C13H8Cl2F3N3O4 MolecularWeight: 398.12153

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=NC(=C1)C(F)(F)F)C(=O)OC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CN1CC(=NC(=C1)C(F)(F)F)C(=O)OC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H8Cl2F3N3O4/c1-20-4-9(19-10(5-20)13(16,17)18)12(22)25-11-7(14)2-6(21(23)24)3-8(11)15/h2-3,5H,4H2,1H3