4-tert-butyl-N-[(E)-1-cyano-3,3-dimethyl-1-[4-(phenylmethyl)phenyl]but-1-en-2-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[(E)-1-cyano-3,3-dimethyl-1-[4-(phenylmethyl)phenyl]but-1-en-2-yl]benzamide Openeye Name: N-[(1E)-1-[(4-benzylphenyl)-cyano-methylene]-2,2-dimethyl-propyl]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-N-[(E)-1-cyano-3,3-dimethyl-1-[4-(phenylmethyl)phenyl]but-1-en-2-yl]benzamide IUPAC Name: N-[(E)-1-(4-benzylphenyl)-1-cyano-3,3-dimethylbut-1-en-2-yl]-4-tert-butylbenzamide Traditional Name: N-[(E)-2-(4-benzylphenyl)-1-tert-butyl-2-cyano-vinyl]-4-tert-butyl-benzamide Formula: C31H34N2O MolecularWeight: 450.61446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=C(C#N)C2=CC=C(C=C2)CC3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N/C(=C(/C#N)\C2=CC=C(C=C2)CC3=CC=CC=C3)/C(C)(C)C

InChI

InChI=1S/C31H34N2O/c1-30(2,3)26-18-16-25(17-19-26)29(34)33-28(31(4,5)6)27(21-32)24-14-12-23(13-15-24)20-22-10-8-7-9-11-22/h7-19H,20H2,1-6H3,(H,33,34)/b28-27-