5-bromanyl-2-(2-methylpropoxy)-N-[4-(3-phenylpropanoylamino)phenyl]benzamide

Systemtic Name: 5-bromanyl-2-(2-methylpropoxy)-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Openeye Name: 5-bromo-2-isobutoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide CAS Name: 5-bromo-2-(2-methylpropoxy)-N-[4-[(1-oxo-3-phenylpropyl)amino]phenyl]benzamide IUPAC Name: 5-bromo-2-(2-methylpropoxy)-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Traditional Name: 5-bromo-N-[4-(hydrocinnamoylamino)phenyl]-2-isobutoxy-benzamide Formula: C26H27BrN2O3 MolecularWeight: 495.40818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)Br)C(=O)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)Br)C(=O)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C26H27BrN2O3/c1-18(2)17-32-24-14-9-20(27)16-23(24)26(31)29-22-12-10-21(11-13-22)28-25(30)15-8-19-6-4-3-5-7-19/h3-7,9-14,16,18H,8,15,17H2,1-2H3,(H,28,30)(H,29,31)