2-(5-ethoxycarbonyl-2-oxidanylidene-azepan-1-yl)butanoic acid

Systemtic Name: 2-(5-ethoxycarbonyl-2-oxidanylidene-azepan-1-yl)butanoic acid Openeye Name: 2-(5-ethoxycarbonyl-2-oxo-azepan-1-yl)butanoic acid CAS Name: 2-(5-ethoxycarbonyl-2-oxo-1-azepanyl)butanoic acid IUPAC Name: 2-(5-ethoxycarbonyl-2-oxoazepan-1-yl)butanoic acid Traditional Name: 2-(5-carbethoxy-2-keto-azepan-1-yl)butyric acid Formula: C13H21NO5 MolecularWeight: 271.30954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1CCC(CCC1=O)C(=O)OCC

Isomeric SMILES

CCC(C(=O)O)N1CCC(CCC1=O)C(=O)OCC

InChI

InChI=1S/C13H21NO5/c1-3-10(12(16)17)14-8-7-9(5-6-11(14)15)13(18)19-4-2/h9-10H,3-8H2,1-2H3,(H,16,17)