tert-butyl (2S,7R)-2-methanoyl-7-methyl-azepane-1-carboxylate

Systemtic Name: tert-butyl (2S,7R)-2-methanoyl-7-methyl-azepane-1-carboxylate Openeye Name: tert-butyl (2S,7R)-2-formyl-7-methyl-azepane-1-carboxylate CAS Name: (2S,7R)-2-formyl-7-methyl-1-azepanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,7R)-2-formyl-7-methylazepane-1-carboxylate Traditional Name: (2S,7R)-2-formyl-7-methyl-azepane-1-carboxylic acid tert-butyl ester Formula: C13H23NO3 MolecularWeight: 241.32662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC(N1C(=O)OC(C)(C)C)C=O

Isomeric SMILES

C[C@@H]1CCCC[C@H](N1C(=O)OC(C)(C)C)C=O

InChI

InChI=1S/C13H23NO3/c1-10-7-5-6-8-11(9-15)14(10)12(16)17-13(2,3)4/h9-11H,5-8H2,1-4H3/t10-,11+/m1/s1