2-[4-[2-(2-bromanyl-4-fluoranyl-phenoxy)propanoyl]piperazin-1-yl]-N-butyl-ethanamide

Systemtic Name: 2-[4-[2-(2-bromanyl-4-fluoranyl-phenoxy)propanoyl]piperazin-1-yl]-N-butyl-ethanamide Openeye Name: 2-[4-[2-(2-bromo-4-fluoro-phenoxy)propanoyl]piperazin-1-yl]-N-butyl-acetamide CAS Name: 2-[4-[2-(2-bromo-4-fluorophenoxy)-1-oxopropyl]-1-piperazinyl]-N-butylacetamide IUPAC Name: 2-[4-[2-(2-bromo-4-fluorophenoxy)propanoyl]piperazin-1-yl]-N-butylacetamide Traditional Name: 2-[4-[2-(2-bromo-4-fluoro-phenoxy)propanoyl]piperazino]-N-butyl-acetamide Formula: C19H27BrFN3O3 MolecularWeight: 444.338383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=O)C(C)OC2=C(C=C(C=C2)F)Br

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=O)C(C)OC2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C19H27BrFN3O3/c1-3-4-7-22-18(25)13-23-8-10-24(11-9-23)19(26)14(2)27-17-6-5-15(21)12-16(17)20/h5-6,12,14H,3-4,7-11,13H2,1-2H3,(H,22,25)