N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(5-fluoranyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(5-fluoranyl-2-nitro-phenoxy)ethanamide Openeye Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(5-fluoro-2-nitro-phenoxy)acetamide CAS Name: N-(3-cyano-4,5-dimethyl-1-phenyl-2-pyrrolyl)-2-(5-fluoro-2-nitrophenoxy)acetamide IUPAC Name: N-(3-cyano-4,5-dimethyl-1-phenylpyrrol-2-yl)-2-(5-fluoro-2-nitrophenoxy)acetamide Traditional Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(5-fluoro-2-nitro-phenoxy)acetamide Formula: C21H17FN4O4 MolecularWeight: 408.382483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)COC2=C(C=CC(=C2)F)[N+](=O)[O-])C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)COC2=C(C=CC(=C2)F)[N+](=O)[O-])C3=CC=CC=C3)C

InChI

InChI=1S/C21H17FN4O4/c1-13-14(2)25(16-6-4-3-5-7-16)21(17(13)11-23)24-20(27)12-30-19-10-15(22)8-9-18(19)26(28)29/h3-10H,12H2,1-2H3,(H,24,27)