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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)C(=O)N3CCCCCC3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)C(=O)N3CCCCCC3)Br

InChI

InChI=1S/C22H25BrN2O3/c1-16-6-11-20(19(23)14-16)28-15-21(26)24-18-9-7-17(8-10-18)22(27)25-12-4-2-3-5-13-25/h6-11,14H,2-5,12-13,15H2,1H3,(H,24,26)