ethyl 2-(3-ethoxy-3-oxidanylidene-propyl)-4-methyl-3-oxidanylidene-1-(phenylcarbonyl)piperidine-4-carboxylate

Systemtic Name: ethyl 2-(3-ethoxy-3-oxidanylidene-propyl)-4-methyl-3-oxidanylidene-1-(phenylcarbonyl)piperidine-4-carboxylate Openeye Name: ethyl 1-benzoyl-2-(3-ethoxy-3-oxo-propyl)-4-methyl-3-oxo-piperidine-4-carboxylate CAS Name: 1-benzoyl-2-(3-ethoxy-3-oxopropyl)-4-methyl-3-oxo-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzoyl-2-(3-ethoxy-3-oxopropyl)-4-methyl-3-oxopiperidine-4-carboxylate Traditional Name: 1-benzoyl-2-(3-ethoxy-3-keto-propyl)-3-keto-4-methyl-isonipecotic acid ethyl ester Formula: C21H27NO6 MolecularWeight: 389.44218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1C(=O)C(CCN1C(=O)C2=CC=CC=C2)(C)C(=O)OCC

Isomeric SMILES

CCOC(=O)CCC1C(=O)C(CCN1C(=O)C2=CC=CC=C2)(C)C(=O)OCC

InChI

InChI=1S/C21H27NO6/c1-4-27-17(23)12-11-16-18(24)21(3,20(26)28-5-2)13-14-22(16)19(25)15-9-7-6-8-10-15/h6-10,16H,4-5,11-14H2,1-3H3