tert-butyl 4-methyl-5-oxidanylidene-azepane-1-carboxylate

Systemtic Name: tert-butyl 4-methyl-5-oxidanylidene-azepane-1-carboxylate Openeye Name: tert-butyl 4-methyl-5-oxo-azepane-1-carboxylate CAS Name: 4-methyl-5-oxo-1-azepanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-methyl-5-oxoazepane-1-carboxylate Traditional Name: 4-keto-5-methyl-azepane-1-carboxylic acid tert-butyl ester Formula: C12H21NO3 MolecularWeight: 227.30004

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CCC1=O)C(=O)OC(C)(C)C

Isomeric SMILES

CC1CCN(CCC1=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C12H21NO3/c1-9-5-7-13(8-6-10(9)14)11(15)16-12(2,3)4/h9H,5-8H2,1-4H3