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

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-(2-bromanyl-4-ethyl-phenoxy)ethanamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(2-bromo-4-ethyl-phenoxy)acetamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-2-(2-bromo-4-ethylphenoxy)acetamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(2-bromo-4-ethylphenoxy)acetamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(2-bromo-4-ethyl-phenoxy)acetamide Formula: C23H27BrN2O3 MolecularWeight: 459.37608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)Br

InChI

InChI=1S/C23H27BrN2O3/c1-2-17-11-12-21(19(24)15-17)29-16-22(27)25-20-10-6-5-9-18(20)23(28)26-13-7-3-4-8-14-26/h5-6,9-12,15H,2-4,7-8,13-14,16H2,1H3,(H,25,27)