N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(2-bromanyl-4,6-dimethyl-phenoxy)ethanamide

Systemtic Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(2-bromanyl-4,6-dimethyl-phenoxy)ethanamide Openeye Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(2-bromo-4,6-dimethyl-phenoxy)acetamide CAS Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(2-bromo-4,6-dimethylphenoxy)acetamide IUPAC Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(2-bromo-4,6-dimethylphenoxy)acetamide Traditional Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(2-bromo-4,6-dimethyl-phenoxy)acetamide Formula: C23H19BrN2O3 MolecularWeight: 451.31256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4O3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4O3)C

InChI

InChI=1S/C23H19BrN2O3/c1-14-10-15(2)22(18(24)11-14)28-13-21(27)25-17-7-5-6-16(12-17)23-26-19-8-3-4-9-20(19)29-23/h3-12H,13H2,1-2H3,(H,25,27)