(E)-1-(azepan-1-yl)-3-(6-ethoxy-3-methyl-1-benzofuran-5-yl)but-2-en-1-one

Systemtic Name: (E)-1-(azepan-1-yl)-3-(6-ethoxy-3-methyl-1-benzofuran-5-yl)but-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-(6-ethoxy-3-methyl-benzofuran-5-yl)but-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-(6-ethoxy-3-methyl-5-benzofuranyl)-2-buten-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-(6-ethoxy-3-methyl-1-benzofuran-5-yl)but-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-(6-ethoxy-3-methyl-benzofuran-5-yl)but-2-en-1-one Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=COC2=C1)C)C(=CC(=O)N3CCCCCC3)C

Isomeric SMILES

CCOC1=C(C=C2C(=COC2=C1)C)/C(=C/C(=O)N3CCCCCC3)/C

InChI

InChI=1S/C21H27NO3/c1-4-24-19-13-20-18(16(3)14-25-20)12-17(19)15(2)11-21(23)22-9-7-5-6-8-10-22/h11-14H,4-10H2,1-3H3/b15-11+