(E)-N-(1,3-benzodioxol-5-yl)-3-(6-ethoxy-3-phenyl-1-benzofuran-5-yl)but-2-enamide

Systemtic Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(6-ethoxy-3-phenyl-1-benzofuran-5-yl)but-2-enamide Openeye Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(6-ethoxy-3-phenyl-benzofuran-5-yl)but-2-enamide CAS Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(6-ethoxy-3-phenyl-5-benzofuranyl)-2-butenamide IUPAC Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(6-ethoxy-3-phenyl-1-benzofuran-5-yl)but-2-enamide Traditional Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(6-ethoxy-3-phenyl-benzofuran-5-yl)but-2-enamide Formula: C27H23NO5 MolecularWeight: 441.47522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)OC=C2C3=CC=CC=C3)C(=CC(=O)NC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)OC=C2C3=CC=CC=C3)/C(=C/C(=O)NC4=CC5=C(C=C4)OCO5)/C

InChI

InChI=1S/C27H23NO5/c1-3-30-24-14-25-21(22(15-31-25)18-7-5-4-6-8-18)13-20(24)17(2)11-27(29)28-19-9-10-23-26(12-19)33-16-32-23/h4-15H,3,16H2,1-2H3,(H,28,29)/b17-11+