tert-butyl 2-methanoyl-7-oxidanylidene-azepane-1-carboxylate

Systemtic Name: tert-butyl 2-methanoyl-7-oxidanylidene-azepane-1-carboxylate Openeye Name: tert-butyl 2-formyl-7-oxo-azepane-1-carboxylate CAS Name: 2-formyl-7-oxo-1-azepanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-formyl-7-oxoazepane-1-carboxylate Traditional Name: 2-formyl-7-keto-azepane-1-carboxylic acid tert-butyl ester Formula: C12H19NO4 MolecularWeight: 241.28356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CCCCC1=O)C=O

Isomeric SMILES

CC(C)(C)OC(=O)N1C(CCCCC1=O)C=O

InChI

InChI=1S/C12H19NO4/c1-12(2,3)17-11(16)13-9(8-14)6-4-5-7-10(13)15/h8-9H,4-7H2,1-3H3