tert-butyl 2-(5-oxidanylidene-2H-furan-2-yl)azepane-1-carboxylate

Systemtic Name: tert-butyl 2-(5-oxidanylidene-2H-furan-2-yl)azepane-1-carboxylate Openeye Name: tert-butyl 2-(5-oxo-2H-furan-2-yl)azepane-1-carboxylate CAS Name: 2-(5-oxo-2H-furan-2-yl)-1-azepanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(5-oxo-2H-furan-2-yl)azepane-1-carboxylate Traditional Name: 2-(5-keto-2H-furan-2-yl)azepane-1-carboxylic acid tert-butyl ester Formula: C15H23NO4 MolecularWeight: 281.34742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCCC1C2C=CC(=O)O2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCCC1C2C=CC(=O)O2

InChI

InChI=1S/C15H23NO4/c1-15(2,3)20-14(18)16-10-6-4-5-7-11(16)12-8-9-13(17)19-12/h8-9,11-12H,4-7,10H2,1-3H3