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

Systemtic Name: (E)-1-(azepan-1-yl)-3-(6-methoxy-3-methyl-1-benzofuran-5-yl)but-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-(6-methoxy-3-methyl-benzofuran-5-yl)but-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-(6-methoxy-3-methyl-5-benzofuranyl)-2-buten-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-(6-methoxy-3-methyl-1-benzofuran-5-yl)but-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-(6-methoxy-3-methyl-benzofuran-5-yl)but-2-en-1-one Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=CC(=C(C=C12)C(=CC(=O)N3CCCCCC3)C)OC

Isomeric SMILES

CC1=COC2=CC(=C(C=C12)/C(=C/C(=O)N3CCCCCC3)/C)OC

InChI

InChI=1S/C20H25NO3/c1-14(10-20(22)21-8-6-4-5-7-9-21)16-11-17-15(2)13-24-19(17)12-18(16)23-3/h10-13H,4-9H2,1-3H3/b14-10+