bis(phenylmethyl) (2S)-2-[[4-(4-oxidanylidenepiperidin-1-yl)phenyl]carbonylamino]pentanedioate

Systemtic Name: bis(phenylmethyl) (2S)-2-[[4-(4-oxidanylidenepiperidin-1-yl)phenyl]carbonylamino]pentanedioate Openeye Name: dibenzyl (2S)-2-[[4-(4-oxo-1-piperidyl)benzoyl]amino]pentanedioate CAS Name: (2S)-2-[[oxo-[4-(4-oxo-1-piperidinyl)phenyl]methyl]amino]pentanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl (2S)-2-[[4-(4-oxopiperidin-1-yl)benzoyl]amino]pentanedioate Traditional Name: (2S)-2-[[4-(4-ketopiperidino)benzoyl]amino]glutaric acid dibenzyl ester Formula: C31H32N2O6 MolecularWeight: 528.59558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)C2=CC=C(C=C2)C(=O)NC(CCC(=O)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1=O)C2=CC=C(C=C2)C(=O)N[C@@H](CCC(=O)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H32N2O6/c34-27-17-19-33(20-18-27)26-13-11-25(12-14-26)30(36)32-28(31(37)39-22-24-9-5-2-6-10-24)15-16-29(35)38-21-23-7-3-1-4-8-23/h1-14,28H,15-22H2,(H,32,36)/t28-/m0/s1