2-[4-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoyl]piperazin-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoyl]piperazin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-[2-(2-bromo-4-fluoro-phenoxy)acetyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[2-(2-bromo-4-fluorophenoxy)-1-oxoethyl]-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-[2-(2-bromo-4-fluorophenoxy)acetyl]piperazin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-[2-(2-bromo-4-fluoro-phenoxy)acetyl]piperazino]acetamide Formula: C21H23BrFN3O3 MolecularWeight: 464.328023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NCC2=CC=CC=C2)C(=O)COC3=C(C=C(C=C3)F)Br

Isomeric SMILES

C1CN(CCN1CC(=O)NCC2=CC=CC=C2)C(=O)COC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C21H23BrFN3O3/c22-18-12-17(23)6-7-19(18)29-15-21(28)26-10-8-25(9-11-26)14-20(27)24-13-16-4-2-1-3-5-16/h1-7,12H,8-11,13-15H2,(H,24,27)