(E)-3-[3-(4-chlorophenyl)-6-methoxy-1-benzofuran-5-yl]-1-(4-ethanoylpiperazin-1-yl)but-2-en-1-one

Systemtic Name: (E)-3-[3-(4-chlorophenyl)-6-methoxy-1-benzofuran-5-yl]-1-(4-ethanoylpiperazin-1-yl)but-2-en-1-one Openeye Name: (E)-1-(4-acetylpiperazin-1-yl)-3-[3-(4-chlorophenyl)-6-methoxy-benzofuran-5-yl]but-2-en-1-one CAS Name: (E)-1-(4-acetyl-1-piperazinyl)-3-[3-(4-chlorophenyl)-6-methoxy-5-benzofuranyl]-2-buten-1-one IUPAC Name: (E)-1-(4-acetylpiperazin-1-yl)-3-[3-(4-chlorophenyl)-6-methoxy-1-benzofuran-5-yl]but-2-en-1-one Traditional Name: (E)-1-(4-acetylpiperazino)-3-[3-(4-chlorophenyl)-6-methoxy-benzofuran-5-yl]but-2-en-1-one Formula: C25H25ClN2O4 MolecularWeight: 452.93

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCN(CC1)C(=O)C)C2=C(C=C3C(=C2)C(=CO3)C4=CC=C(C=C4)Cl)OC

Isomeric SMILES

C/C(=C\C(=O)N1CCN(CC1)C(=O)C)/C2=C(C=C3C(=C2)C(=CO3)C4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C25H25ClN2O4/c1-16(12-25(30)28-10-8-27(9-11-28)17(2)29)20-13-21-22(18-4-6-19(26)7-5-18)15-32-24(21)14-23(20)31-3/h4-7,12-15H,8-11H2,1-3H3/b16-12+