diethyl 2-[[[(2S,3R,4S,5S,6S)-6-methyl-5-methylsulfonyloxy-3,4-bis(phenylcarbonyloxy)oxan-2-yl]amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[[(2S,3R,4S,5S,6S)-6-methyl-5-methylsulfonyloxy-3,4-bis(phenylcarbonyloxy)oxan-2-yl]amino]methylidene]propanedioate Openeye Name: diethyl 2-[[[(2S,3R,4S,5S,6S)-3,4-dibenzoyloxy-6-methyl-5-methylsulfonyloxy-tetrahydropyran-2-yl]amino]methylene]propanedioate CAS Name: 2-[[[(2S,3R,4S,5S,6S)-3,4-dibenzoyloxy-6-methyl-5-methylsulfonyloxy-2-oxanyl]amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[[(2S,3R,4S,5S,6S)-3,4-dibenzoyloxy-6-methyl-5-methylsulfonyloxyoxan-2-yl]amino]methylidene]propanedioate Traditional Name: 2-[[[(2S,3R,4S,5S,6S)-3,4-dibenzoyloxy-6-methyl-5-methylsulfonyloxy-tetrahydropyran-2-yl]amino]methylene]malonic acid diethyl ester Formula: C29H33NO12S MolecularWeight: 619.63682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1C(C(C(C(O1)C)OS(=O)(=O)C)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C29H33NO12S/c1-5-37-28(33)21(29(34)38-6-2)17-30-25-24(41-27(32)20-15-11-8-12-16-20)23(22(18(3)39-25)42-43(4,35)36)40-26(31)19-13-9-7-10-14-19/h7-18,22-25,30H,5-6H2,1-4H3/t18-,22-,23+,24+,25-/m0/s1