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

Systemtic Name: (E)-3-(6-ethoxy-3-phenyl-1-benzofuran-5-yl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]but-2-en-1-one Openeye Name: (E)-3-(6-ethoxy-3-phenyl-benzofuran-5-yl)-1-[4-(3-pyridylmethyl)piperazin-1-yl]but-2-en-1-one CAS Name: (E)-3-(6-ethoxy-3-phenyl-5-benzofuranyl)-1-[4-(3-pyridinylmethyl)-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-3-(6-ethoxy-3-phenyl-1-benzofuran-5-yl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]but-2-en-1-one Traditional Name: (E)-3-(6-ethoxy-3-phenyl-benzofuran-5-yl)-1-[4-(3-pyridylmethyl)piperazino]but-2-en-1-one Formula: C30H31N3O3 MolecularWeight: 481.58544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)OC=C2C3=CC=CC=C3)C(=CC(=O)N4CCN(CC4)CC5=CN=CC=C5)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)OC=C2C3=CC=CC=C3)/C(=C/C(=O)N4CCN(CC4)CC5=CN=CC=C5)/C

InChI

InChI=1S/C30H31N3O3/c1-3-35-28-18-29-26(27(21-36-29)24-9-5-4-6-10-24)17-25(28)22(2)16-30(34)33-14-12-32(13-15-33)20-23-8-7-11-31-19-23/h4-11,16-19,21H,3,12-15,20H2,1-2H3/b22-16+