4-chloranyl-1-ethoxy-3-[[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]imino]but-1-en-1-olate

Systemtic Name: 4-chloranyl-1-ethoxy-3-[[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]imino]but-1-en-1-olate Openeye Name: 4-chloro-1-ethoxy-3-[[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]imino]but-1-en-1-olate CAS Name: 4-chloro-1-ethoxy-3-[[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]imino]-1-buten-1-olate IUPAC Name: 4-chloro-1-ethoxy-3-[[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]imino]but-1-en-1-olate Traditional Name: 4-chloro-1-ethoxy-3-[[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]imino]but-1-en-1-olate Formula: C9H9ClF3N4O2- MolecularWeight: 297.64157

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=CC(=NC1=NNC(=N1)C(F)(F)F)CCl)[O-]

Isomeric SMILES

CCOC(=CC(=NC1=NNC(=N1)C(F)(F)F)CCl)[O-]

InChI

InChI=1S/C9H10ClF3N4O2/c1-2-19-6(18)3-5(4-10)14-8-15-7(16-17-8)9(11,12)13/h3,18H,2,4H2,1H3,(H,15,16,17)/p-1