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

Systemtic Name: (E)-1-(azepan-1-yl)-3-(6-ethoxy-2,3-dimethyl-1-benzofuran-5-yl)but-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-(6-ethoxy-2,3-dimethyl-benzofuran-5-yl)but-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-(6-ethoxy-2,3-dimethyl-5-benzofuranyl)-2-buten-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-(6-ethoxy-2,3-dimethyl-1-benzofuran-5-yl)but-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-(6-ethoxy-2,3-dimethyl-benzofuran-5-yl)but-2-en-1-one Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C(OC2=C1)C)C)C(=CC(=O)N3CCCCCC3)C

Isomeric SMILES

CCOC1=C(C=C2C(=C(OC2=C1)C)C)/C(=C/C(=O)N3CCCCCC3)/C

InChI

InChI=1S/C22H29NO3/c1-5-25-20-14-21-19(16(3)17(4)26-21)13-18(20)15(2)12-22(24)23-10-8-6-7-9-11-23/h12-14H,5-11H2,1-4H3/b15-12+