4-bromanyl-N-(2-cyano-1,1-diphenyl-pentyl)benzamide

Systemtic Name: 4-bromanyl-N-(2-cyano-1,1-diphenyl-pentyl)benzamide Openeye Name: 4-bromo-N-(2-cyano-1,1-diphenyl-pentyl)benzamide CAS Name: 4-bromo-N-(2-cyano-1,1-diphenylpentyl)benzamide IUPAC Name: 4-bromo-N-(2-cyano-1,1-diphenylpentyl)benzamide Traditional Name: 4-bromo-N-(2-cyano-1,1-diphenyl-pentyl)benzamide Formula: C25H23BrN2O MolecularWeight: 447.36692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23BrN2O/c1-2-9-22(18-27)25(20-10-5-3-6-11-20,21-12-7-4-8-13-21)28-24(29)19-14-16-23(26)17-15-19/h3-8,10-17,22H,2,9H2,1H3,(H,28,29)