N-(4-acetamido-2-cyano-3,6-dimethoxy-phenyl)-2,2,2-tris(fluoranyl)ethanamide

Systemtic Name: N-(4-acetamido-2-cyano-3,6-dimethoxy-phenyl)-2,2,2-tris(fluoranyl)ethanamide Openeye Name: N-(4-acetamido-2-cyano-3,6-dimethoxy-phenyl)-2,2,2-trifluoro-acetamide CAS Name: N-(4-acetamido-2-cyano-3,6-dimethoxyphenyl)-2,2,2-trifluoroacetamide IUPAC Name: N-(4-acetamido-2-cyano-3,6-dimethoxyphenyl)-2,2,2-trifluoroacetamide Traditional Name: N-(4-acetamido-2-cyano-3,6-dimethoxy-phenyl)-2,2,2-trifluoro-acetamide Formula: C13H12F3N3O4 MolecularWeight: 331.24729

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C(=C1OC)C#N)NC(=O)C(F)(F)F)OC

Isomeric SMILES

CC(=O)NC1=CC(=C(C(=C1OC)C#N)NC(=O)C(F)(F)F)OC

InChI

InChI=1S/C13H12F3N3O4/c1-6(20)18-8-4-9(22-2)10(7(5-17)11(8)23-3)19-12(21)13(14,15)16/h4H,1-3H3,(H,18,20)(H,19,21)