2-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: 2-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: 2-[[1-(4-iodophenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: 2-[[1-(4-iodophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: 3-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-pivaloyl-acrylonitrile Formula: C20H21IN2O MolecularWeight: 432.29801

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)C=C(C#N)C(=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)C=C(C#N)C(=O)C(C)(C)C

InChI

InChI=1S/C20H21IN2O/c1-13-10-15(11-16(12-22)19(24)20(3,4)5)14(2)23(13)18-8-6-17(21)7-9-18/h6-11H,1-5H3