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

Systemtic Name: diethyl 2-[[[(2R,3R,4R,5R,6R)-6-[(4-methoxyphenyl)methoxymethyl]-5-methylsulfonyloxy-3,4-bis(phenylcarbonyloxy)oxan-2-yl]amino]methylidene]propanedioate Openeye Name: diethyl 2-[[[(2R,3R,4R,5R,6R)-3,4-dibenzoyloxy-6-[(4-methoxyphenyl)methoxymethyl]-5-methylsulfonyloxy-tetrahydropyran-2-yl]amino]methylene]propanedioate CAS Name: 2-[[[(2R,3R,4R,5R,6R)-3,4-dibenzoyloxy-6-[(4-methoxyphenyl)methoxymethyl]-5-methylsulfonyloxy-2-oxanyl]amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[[(2R,3R,4R,5R,6R)-3,4-dibenzoyloxy-6-[(4-methoxyphenyl)methoxymethyl]-5-methylsulfonyloxyoxan-2-yl]amino]methylidene]propanedioate Traditional Name: 2-[[[(2R,3R,4R,5R,6R)-3,4-dibenzoyloxy-5-methylsulfonyloxy-6-(p-anisyloxymethyl)tetrahydropyran-2-yl]amino]methylene]malonic acid diethyl ester Formula: C37H41NO14S MolecularWeight: 755.78474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1C(C(C(C(O1)COCC2=CC=C(C=C2)OC)OS(=O)(=O)C)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CN[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COCC2=CC=C(C=C2)OC)OS(=O)(=O)C)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C37H41NO14S/c1-5-47-36(41)28(37(42)48-6-2)21-38-33-32(51-35(40)26-15-11-8-12-16-26)31(50-34(39)25-13-9-7-10-14-25)30(52-53(4,43)44)29(49-33)23-46-22-24-17-19-27(45-3)20-18-24/h7-21,29-33,38H,5-6,22-23H2,1-4H3/t29-,30-,31+,32-,33-/m1/s1