N-[(E)-1-cyano-3,3-dimethyl-1-(4-phenylphenyl)but-1-en-2-yl]-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxamide

Systemtic Name: N-[(E)-1-cyano-3,3-dimethyl-1-(4-phenylphenyl)but-1-en-2-yl]-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxamide Openeye Name: N-[(1E)-1-[cyano-(4-phenylphenyl)methylene]-2,2-dimethyl-propyl]-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxamide CAS Name: N-[(E)-1-cyano-3,3-dimethyl-1-(4-phenylphenyl)but-1-en-2-yl]-1-methyl-4-(trifluoromethyl)-3-pyrrolecarboxamide IUPAC Name: N-[(E)-1-cyano-3,3-dimethyl-1-(4-phenylphenyl)but-1-en-2-yl]-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxamide Traditional Name: N-[(E)-1-tert-butyl-2-cyano-2-(4-phenylphenyl)vinyl]-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxamide Formula: C26H24F3N3O MolecularWeight: 451.48347

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=C(C#N)C1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)C3=CN(C=C3C(F)(F)F)C

Isomeric SMILES

CC(C)(C)/C(=C(\C#N)/C1=CC=C(C=C1)C2=CC=CC=C2)/NC(=O)C3=CN(C=C3C(F)(F)F)C

InChI

InChI=1S/C26H24F3N3O/c1-25(2,3)23(31-24(33)21-15-32(4)16-22(21)26(27,28)29)20(14-30)19-12-10-18(11-13-19)17-8-6-5-7-9-17/h5-13,15-16H,1-4H3,(H,31,33)/b23-20-