2-(4-bromanylphenoxy)-1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanylphenoxy)-1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-bromophenoxy)-1-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]ethanone CAS Name: 2-(4-bromophenoxy)-1-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromophenoxy)-1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-bromophenoxy)-1-[4-(coumaran-5-ylmethyl)piperazino]ethanone Formula: C21H23BrN2O3 MolecularWeight: 431.32292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)COC4=CC=C(C=C4)Br

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H23BrN2O3/c22-18-2-4-19(5-3-18)27-15-21(25)24-10-8-23(9-11-24)14-16-1-6-20-17(13-16)7-12-26-20/h1-6,13H,7-12,14-15H2