(E)-3-(6-methoxy-3-methyl-1-benzofuran-5-yl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]but-2-en-1-one

Systemtic Name: (E)-3-(6-methoxy-3-methyl-1-benzofuran-5-yl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]but-2-en-1-one Openeye Name: (E)-3-(6-methoxy-3-methyl-benzofuran-5-yl)-1-[4-(4-pyridylmethyl)piperazin-1-yl]but-2-en-1-one CAS Name: (E)-3-(6-methoxy-3-methyl-5-benzofuranyl)-1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-3-(6-methoxy-3-methyl-1-benzofuran-5-yl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]but-2-en-1-one Traditional Name: (E)-3-(6-methoxy-3-methyl-benzofuran-5-yl)-1-[4-(4-pyridylmethyl)piperazino]but-2-en-1-one Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=CC(=C(C=C12)C(=CC(=O)N3CCN(CC3)CC4=CC=NC=C4)C)OC

Isomeric SMILES

CC1=COC2=CC(=C(C=C12)/C(=C/C(=O)N3CCN(CC3)CC4=CC=NC=C4)/C)OC

InChI

InChI=1S/C24H27N3O3/c1-17(20-13-21-18(2)16-30-23(21)14-22(20)29-3)12-24(28)27-10-8-26(9-11-27)15-19-4-6-25-7-5-19/h4-7,12-14,16H,8-11,15H2,1-3H3/b17-12+