diethyl (4S,5S)-2-[6-oxidanylidene-1-(phenylmethyl)pyridin-3-yl]-1,3-dioxolane-4,5-dicarboxylate

Systemtic Name: diethyl (4S,5S)-2-[6-oxidanylidene-1-(phenylmethyl)pyridin-3-yl]-1,3-dioxolane-4,5-dicarboxylate Openeye Name: diethyl (4S,5S)-2-(1-benzyl-6-oxo-3-pyridyl)-1,3-dioxolane-4,5-dicarboxylate CAS Name: (4S,5S)-2-[6-oxo-1-(phenylmethyl)-3-pyridinyl]-1,3-dioxolane-4,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl (4S,5S)-2-(1-benzyl-6-oxopyridin-3-yl)-1,3-dioxolane-4,5-dicarboxylate Traditional Name: (4S,5S)-2-(1-benzyl-6-keto-3-pyridyl)-1,3-dioxolane-4,5-dicarboxylic acid diethyl ester Formula: C21H23NO7 MolecularWeight: 401.40982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(OC(O1)C2=CN(C(=O)C=C2)CC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](OC(O1)C2=CN(C(=O)C=C2)CC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C21H23NO7/c1-3-26-19(24)17-18(20(25)27-4-2)29-21(28-17)15-10-11-16(23)22(13-15)12-14-8-6-5-7-9-14/h5-11,13,17-18,21H,3-4,12H2,1-2H3/t17-,18-/m0/s1