dimethyl (2S,6R)-4-oxidanylidene-1-(phenylmethyl)-2,6-dipyridin-2-yl-piperidine-3,5-dicarboxylate

Systemtic Name: dimethyl (2S,6R)-4-oxidanylidene-1-(phenylmethyl)-2,6-dipyridin-2-yl-piperidine-3,5-dicarboxylate Openeye Name: dimethyl (2S,6R)-1-benzyl-4-oxo-2,6-bis(2-pyridyl)piperidine-3,5-dicarboxylate CAS Name: (2S,6R)-4-oxo-1-(phenylmethyl)-2,6-bis(2-pyridinyl)piperidine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,6R)-1-benzyl-4-oxo-2,6-dipyridin-2-ylpiperidine-3,5-dicarboxylate Traditional Name: (2S,6R)-1-benzyl-4-keto-2,6-bis(2-pyridyl)piperidine-3,5-dicarboxylic acid dimethyl ester Formula: C26H25N3O5 MolecularWeight: 459.4938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(N(C(C(C1=O)C(=O)OC)C2=CC=CC=N2)CC3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

COC(=O)C1[C@@H](N([C@@H](C(C1=O)C(=O)OC)C2=CC=CC=N2)CC3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C26H25N3O5/c1-33-25(31)20-22(18-12-6-8-14-27-18)29(16-17-10-4-3-5-11-17)23(19-13-7-9-15-28-19)21(24(20)30)26(32)34-2/h3-15,20-23H,16H2,1-2H3/t20?,21?,22-,23+