(E)-3-(6-methoxy-2,3-dimethyl-1-benzofuran-5-yl)-1-(4-phenethylpiperazin-1-yl)but-2-en-1-one

Systemtic Name: (E)-3-(6-methoxy-2,3-dimethyl-1-benzofuran-5-yl)-1-(4-phenethylpiperazin-1-yl)but-2-en-1-one Openeye Name: (E)-3-(6-methoxy-2,3-dimethyl-benzofuran-5-yl)-1-(4-phenethylpiperazin-1-yl)but-2-en-1-one CAS Name: (E)-3-(6-methoxy-2,3-dimethyl-5-benzofuranyl)-1-(4-phenethyl-1-piperazinyl)-2-buten-1-one IUPAC Name: (E)-3-(6-methoxy-2,3-dimethyl-1-benzofuran-5-yl)-1-(4-phenethylpiperazin-1-yl)but-2-en-1-one Traditional Name: (E)-3-(6-methoxy-2,3-dimethyl-benzofuran-5-yl)-1-(4-phenethylpiperazino)but-2-en-1-one Formula: C27H32N2O3 MolecularWeight: 432.55458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC(=C(C=C12)C(=CC(=O)N3CCN(CC3)CCC4=CC=CC=C4)C)OC)C

Isomeric SMILES

CC1=C(OC2=CC(=C(C=C12)/C(=C/C(=O)N3CCN(CC3)CCC4=CC=CC=C4)/C)OC)C

InChI

InChI=1S/C27H32N2O3/c1-19(23-17-24-20(2)21(3)32-26(24)18-25(23)31-4)16-27(30)29-14-12-28(13-15-29)11-10-22-8-6-5-7-9-22/h5-9,16-18H,10-15H2,1-4H3/b19-16+