tert-butyl 2-(3-ethoxy-3-oxidanylidene-propyl)azepane-1-carboxylate

Systemtic Name: tert-butyl 2-(3-ethoxy-3-oxidanylidene-propyl)azepane-1-carboxylate Openeye Name: tert-butyl 2-(3-ethoxy-3-oxo-propyl)azepane-1-carboxylate CAS Name: 2-(3-ethoxy-3-oxopropyl)-1-azepanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3-ethoxy-3-oxopropyl)azepane-1-carboxylate Traditional Name: 2-(3-ethoxy-3-keto-propyl)azepane-1-carboxylic acid tert-butyl ester Formula: C16H29NO4 MolecularWeight: 299.40576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1CCCCCN1C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CCC1CCCCCN1C(=O)OC(C)(C)C

InChI

InChI=1S/C16H29NO4/c1-5-20-14(18)11-10-13-9-7-6-8-12-17(13)15(19)21-16(2,3)4/h13H,5-12H2,1-4H3