(E)-N-(3-imidazol-1-ylpropyl)-3-(6-methoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enamide

Systemtic Name: (E)-N-(3-imidazol-1-ylpropyl)-3-(6-methoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enamide Openeye Name: (E)-N-(3-imidazol-1-ylpropyl)-3-(6-methoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-enamide CAS Name: (E)-N-[3-(1-imidazolyl)propyl]-3-(6-methoxy-2,3,7-trimethyl-5-benzofuranyl)-2-butenamide IUPAC Name: (E)-N-(3-imidazol-1-ylpropyl)-3-(6-methoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enamide Traditional Name: (E)-N-(3-imidazol-1-ylpropyl)-3-(6-methoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-enamide Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C(=C(C=C12)C(=CC(=O)NCCCN3C=CN=C3)C)OC)C)C

Isomeric SMILES

CC1=C(OC2=C(C(=C(C=C12)/C(=C/C(=O)NCCCN3C=CN=C3)/C)OC)C)C

InChI

InChI=1S/C22H27N3O3/c1-14(11-20(26)24-7-6-9-25-10-8-23-13-25)18-12-19-15(2)17(4)28-22(19)16(3)21(18)27-5/h8,10-13H,6-7,9H2,1-5H3,(H,24,26)/b14-11+