(phenylmethyl) (2S,6S)-6-(2-ethoxy-2-oxidanylidene-ethyl)-5-methoxy-2-(2-phenylethynyl)-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S,6S)-6-(2-ethoxy-2-oxidanylidene-ethyl)-5-methoxy-2-(2-phenylethynyl)-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: benzyl (2S,6S)-6-(2-ethoxy-2-oxo-ethyl)-5-methoxy-2-(2-phenylethynyl)-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: (2S,6S)-6-(2-ethoxy-2-oxoethyl)-5-methoxy-2-(2-phenylethynyl)-3,6-dihydro-2H-pyridine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,6S)-6-(2-ethoxy-2-oxoethyl)-5-methoxy-2-(2-phenylethynyl)-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: (2S,6S)-6-(2-ethoxy-2-keto-ethyl)-5-methoxy-2-(2-phenylethynyl)-3,6-dihydro-2H-pyridine-1-carboxylic acid benzyl ester Formula: C26H27NO5 MolecularWeight: 433.49628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=CCC(N1C(=O)OCC2=CC=CC=C2)C#CC3=CC=CC=C3)OC

Isomeric SMILES

CCOC(=O)C[C@H]1C(=CC[C@H](N1C(=O)OCC2=CC=CC=C2)C#CC3=CC=CC=C3)OC

InChI

InChI=1S/C26H27NO5/c1-3-31-25(28)18-23-24(30-2)17-16-22(15-14-20-10-6-4-7-11-20)27(23)26(29)32-19-21-12-8-5-9-13-21/h4-13,17,22-23H,3,16,18-19H2,1-2H3/t22-,23+/m1/s1