O1-tert-butyl O4-ethyl 5-oxidanylazepane-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-ethyl 5-oxidanylazepane-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-ethyl 5-hydroxyazepane-1,4-dicarboxylate CAS Name: 5-hydroxyazepane-1,4-dicarboxylic acid O1-tert-butyl ester O4-ethyl ester IUPAC Name: 1-O-tert-butyl 4-O-ethyl 5-hydroxyazepane-1,4-dicarboxylate Traditional Name: 5-hydroxyazepane-1,4-dicarboxylic acid O1-tert-butyl ester O4-ethyl ester Formula: C14H25NO5 MolecularWeight: 287.352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CCC1O)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1CCN(CCC1O)C(=O)OC(C)(C)C

InChI

InChI=1S/C14H25NO5/c1-5-19-12(17)10-6-8-15(9-7-11(10)16)13(18)20-14(2,3)4/h10-11,16H,5-9H2,1-4H3