O1-methyl O3-(phenylmethyl) (3R,4S)-2-oxidanylidene-4-[(E)-4-oxidanylidenebut-2-enyl]piperidine-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-(phenylmethyl) (3R,4S)-2-oxidanylidene-4-[(E)-4-oxidanylidenebut-2-enyl]piperidine-1,3-dicarboxylate Openeye Name: O3-benzyl O1-methyl (3R,4S)-2-oxo-4-[(E)-4-oxobut-2-enyl]piperidine-1,3-dicarboxylate CAS Name: (3R,4S)-2-oxo-4-[(E)-4-oxobut-2-enyl]piperidine-1,3-dicarboxylic acid O1-methyl ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 1-O-methyl (3R,4S)-2-oxo-4-[(E)-4-oxobut-2-enyl]piperidine-1,3-dicarboxylate Traditional Name: (3R,4S)-2-keto-4-[(E)-4-ketobut-2-enyl]piperidine-1,3-dicarboxylic acid O3-benzyl ester O1-methyl ester Formula: C19H21NO6 MolecularWeight: 359.37314

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC(C(C1=O)C(=O)OCC2=CC=CC=C2)CC=CC=O

Isomeric SMILES

COC(=O)N1CC[C@@H]([C@H](C1=O)C(=O)OCC2=CC=CC=C2)C/C=C/C=O

InChI

InChI=1S/C19H21NO6/c1-25-19(24)20-11-10-15(9-5-6-12-21)16(17(20)22)18(23)26-13-14-7-3-2-4-8-14/h2-8,12,15-16H,9-11,13H2,1H3/b6-5+/t15-,16+/m0/s1