(E)-3-[3-(4-chlorophenyl)-6-ethoxy-1-benzofuran-5-yl]-N-(3-imidazol-1-ylpropyl)but-2-enamide

Systemtic Name: (E)-3-[3-(4-chlorophenyl)-6-ethoxy-1-benzofuran-5-yl]-N-(3-imidazol-1-ylpropyl)but-2-enamide Openeye Name: (E)-3-[3-(4-chlorophenyl)-6-ethoxy-benzofuran-5-yl]-N-(3-imidazol-1-ylpropyl)but-2-enamide CAS Name: (E)-3-[3-(4-chlorophenyl)-6-ethoxy-5-benzofuranyl]-N-[3-(1-imidazolyl)propyl]-2-butenamide IUPAC Name: (E)-3-[3-(4-chlorophenyl)-6-ethoxy-1-benzofuran-5-yl]-N-(3-imidazol-1-ylpropyl)but-2-enamide Traditional Name: (E)-3-[3-(4-chlorophenyl)-6-ethoxy-benzofuran-5-yl]-N-(3-imidazol-1-ylpropyl)but-2-enamide Formula: C26H26ClN3O3 MolecularWeight: 463.95594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)OC=C2C3=CC=C(C=C3)Cl)C(=CC(=O)NCCCN4C=CN=C4)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)OC=C2C3=CC=C(C=C3)Cl)/C(=C/C(=O)NCCCN4C=CN=C4)/C

InChI

InChI=1S/C26H26ClN3O3/c1-3-32-24-15-25-22(23(16-33-25)19-5-7-20(27)8-6-19)14-21(24)18(2)13-26(31)29-9-4-11-30-12-10-28-17-30/h5-8,10,12-17H,3-4,9,11H2,1-2H3,(H,29,31)/b18-13+