ethyl 2-(7-ethoxy-7-oxidanylidene-heptyl)-3,6-bis(oxidanylidene)-1-(3-phenylmethoxyoctyl)piperidine-4-carboxylate

Systemtic Name: ethyl 2-(7-ethoxy-7-oxidanylidene-heptyl)-3,6-bis(oxidanylidene)-1-(3-phenylmethoxyoctyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(3-benzyloxyoctyl)-2-(7-ethoxy-7-oxo-heptyl)-3,6-dioxo-piperidine-4-carboxylate CAS Name: 2-(7-ethoxy-7-oxoheptyl)-3,6-dioxo-1-(3-phenylmethoxyoctyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(7-ethoxy-7-oxoheptyl)-3,6-dioxo-1-(3-phenylmethoxyoctyl)piperidine-4-carboxylate Traditional Name: 1-(3-benzoxyoctyl)-2-(7-ethoxy-7-keto-heptyl)-3,6-diketo-isonipecotic acid ethyl ester Formula: C32H49NO7 MolecularWeight: 559.73396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCN1C(C(=O)C(CC1=O)C(=O)OCC)CCCCCCC(=O)OCC)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCC(CCN1C(C(=O)C(CC1=O)C(=O)OCC)CCCCCCC(=O)OCC)OCC2=CC=CC=C2

InChI

InChI=1S/C32H49NO7/c1-4-7-11-18-26(40-24-25-16-12-10-13-17-25)21-22-33-28(19-14-8-9-15-20-30(35)38-5-2)31(36)27(23-29(33)34)32(37)39-6-3/h10,12-13,16-17,26-28H,4-9,11,14-15,18-24H2,1-3H3