(E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)-1-(4-phenylpiperazin-1-yl)but-2-en-1-one

Systemtic Name: (E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)-1-(4-phenylpiperazin-1-yl)but-2-en-1-one Openeye Name: (E)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)-1-(4-phenylpiperazin-1-yl)but-2-en-1-one CAS Name: (E)-3-(6-methoxy-3,7-dimethyl-5-benzofuranyl)-1-(4-phenyl-1-piperazinyl)-2-buten-1-one IUPAC Name: (E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)-1-(4-phenylpiperazin-1-yl)but-2-en-1-one Traditional Name: (E)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)-1-(4-phenylpiperazino)but-2-en-1-one Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O3/c1-17(21-15-22-18(2)16-30-25(22)19(3)24(21)29-4)14-23(28)27-12-10-26(11-13-27)20-8-6-5-7-9-20/h5-9,14-16H,10-13H2,1-4H3/b17-14+