ethyl (3R)-1-[8-(diphenylamino)-8-oxidanylidene-octyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-1-[8-(diphenylamino)-8-oxidanylidene-octyl]piperidine-3-carboxylate Openeye Name: ethyl (3R)-1-[8-oxo-8-(N-phenylanilino)octyl]piperidine-3-carboxylate CAS Name: (3R)-1-[8-oxo-8-(N-phenylanilino)octyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-[8-oxo-8-(N-phenylanilino)octyl]piperidine-3-carboxylate Traditional Name: (3R)-1-[8-keto-8-(N-phenylanilino)octyl]nipecotic acid ethyl ester Formula: C28H38N2O3 MolecularWeight: 450.61292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CCCCCCCC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H]1CCCN(C1)CCCCCCCC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C28H38N2O3/c1-2-33-28(32)24-15-14-22-29(23-24)21-13-5-3-4-12-20-27(31)30(25-16-8-6-9-17-25)26-18-10-7-11-19-26/h6-11,16-19,24H,2-5,12-15,20-23H2,1H3/t24-/m1/s1