N-[2-(azepan-1-ylcarbonyl)phenyl]-2-(4-bromanyl-3-methyl-phenoxy)ethanamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-(4-bromanyl-3-methyl-phenoxy)ethanamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(4-bromo-3-methyl-phenoxy)acetamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-2-(4-bromo-3-methylphenoxy)acetamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(4-bromo-3-methylphenoxy)acetamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(4-bromo-3-methyl-phenoxy)acetamide Formula: C22H25BrN2O3 MolecularWeight: 445.3495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)Br

InChI

InChI=1S/C22H25BrN2O3/c1-16-14-17(10-11-19(16)23)28-15-21(26)24-20-9-5-4-8-18(20)22(27)25-12-6-2-3-7-13-25/h4-5,8-11,14H,2-3,6-7,12-13,15H2,1H3,(H,24,26)