ethyl 3-[2-(2-oxidanylideneazepan-1-yl)ethanoyloxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[2-(2-oxidanylideneazepan-1-yl)ethanoyloxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[2-(2-oxoazepan-1-yl)acetyl]oxymethyl]benzofuran-2-carboxylate CAS Name: 3-[[1-oxo-2-(2-oxo-1-azepanyl)ethoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2-oxoazepan-1-yl)acetyl]oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[2-(2-ketoazepan-1-yl)acetyl]oxymethyl]coumarilic acid ethyl ester Formula: C20H23NO6 MolecularWeight: 373.39972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)CN3CCCCCC3=O

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)CN3CCCCCC3=O

InChI

InChI=1S/C20H23NO6/c1-2-25-20(24)19-15(14-8-5-6-9-16(14)27-19)13-26-18(23)12-21-11-7-3-4-10-17(21)22/h5-6,8-9H,2-4,7,10-13H2,1H3