N-[(E)-1,2-dicyano-2-(2,5-dimethylpyrrol-1-yl)ethenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[(E)-1,2-dicyano-2-(2,5-dimethylpyrrol-1-yl)ethenyl]-4-fluoranyl-benzamide Openeye Name: N-[(E)-1,2-dicyano-2-(2,5-dimethylpyrrol-1-yl)vinyl]-4-fluoro-benzamide CAS Name: N-[(E)-1,2-dicyano-2-(2,5-dimethyl-1-pyrrolyl)ethenyl]-4-fluorobenzamide IUPAC Name: N-[(E)-1,2-dicyano-2-(2,5-dimethylpyrrol-1-yl)ethenyl]-4-fluorobenzamide Traditional Name: N-[(E)-1,2-dicyano-2-(2,5-dimethylpyrrol-1-yl)vinyl]-4-fluoro-benzamide Formula: C17H13FN4O MolecularWeight: 308.309723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C(=C(C#N)NC(=O)C2=CC=C(C=C2)F)C#N)C

Isomeric SMILES

CC1=CC=C(N1/C(=C(\C#N)/NC(=O)C2=CC=C(C=C2)F)/C#N)C

InChI

InChI=1S/C17H13FN4O/c1-11-3-4-12(2)22(11)16(10-20)15(9-19)21-17(23)13-5-7-14(18)8-6-13/h3-8H,1-2H3,(H,21,23)/b16-15+