(E)-3-(6-ethoxy-3-methyl-1-benzofuran-5-yl)-1-[4-(2-fluorophenyl)piperazin-1-yl]but-2-en-1-one

Systemtic Name: (E)-3-(6-ethoxy-3-methyl-1-benzofuran-5-yl)-1-[4-(2-fluorophenyl)piperazin-1-yl]but-2-en-1-one Openeye Name: (E)-3-(6-ethoxy-3-methyl-benzofuran-5-yl)-1-[4-(2-fluorophenyl)piperazin-1-yl]but-2-en-1-one CAS Name: (E)-3-(6-ethoxy-3-methyl-5-benzofuranyl)-1-[4-(2-fluorophenyl)-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-3-(6-ethoxy-3-methyl-1-benzofuran-5-yl)-1-[4-(2-fluorophenyl)piperazin-1-yl]but-2-en-1-one Traditional Name: (E)-3-(6-ethoxy-3-methyl-benzofuran-5-yl)-1-[4-(2-fluorophenyl)piperazino]but-2-en-1-one Formula: C25H27FN2O3 MolecularWeight: 422.491883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=COC2=C1)C)C(=CC(=O)N3CCN(CC3)C4=CC=CC=C4F)C

Isomeric SMILES

CCOC1=C(C=C2C(=COC2=C1)C)/C(=C/C(=O)N3CCN(CC3)C4=CC=CC=C4F)/C

InChI

InChI=1S/C25H27FN2O3/c1-4-30-23-15-24-20(18(3)16-31-24)14-19(23)17(2)13-25(29)28-11-9-27(10-12-28)22-8-6-5-7-21(22)26/h5-8,13-16H,4,9-12H2,1-3H3/b17-13+