[(2R,3R,4R,5S)-3,4,5-tris(2-methylpropanoyloxy)-1-(2-phenylethanoyl)piperidin-2-yl]methyl 2-methylpropanoate

Systemtic Name: [(2R,3R,4R,5S)-3,4,5-tris(2-methylpropanoyloxy)-1-(2-phenylethanoyl)piperidin-2-yl]methyl 2-methylpropanoate Openeye Name: [(2R,3R,4R,5S)-3,4,5-tris(2-methylpropanoyloxy)-1-(2-phenylacetyl)-2-piperidyl]methyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid [(2R,3R,4R,5S)-3,4,5-tris(2-methyl-1-oxopropoxy)-1-(1-oxo-2-phenylethyl)-2-piperidinyl]methyl ester IUPAC Name: [(2R,3R,4R,5S)-3,4,5-tris(2-methylpropanoyloxy)-1-(2-phenylacetyl)piperidin-2-yl]methyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid [(2R,3R,4R,5S)-3,4,5-triisobutyryloxy-1-(2-phenylacetyl)-2-piperidyl]methyl ester Formula: C30H43NO9 MolecularWeight: 561.66372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCC1C(C(C(CN1C(=O)CC2=CC=CC=C2)OC(=O)C(C)C)OC(=O)C(C)C)OC(=O)C(C)C

Isomeric SMILES

CC(C)C(=O)OC[C@@H]1[C@H]([C@@H]([C@H](CN1C(=O)CC2=CC=CC=C2)OC(=O)C(C)C)OC(=O)C(C)C)OC(=O)C(C)C

InChI

InChI=1S/C30H43NO9/c1-17(2)27(33)37-16-22-25(39-29(35)19(5)6)26(40-30(36)20(7)8)23(38-28(34)18(3)4)15-31(22)24(32)14-21-12-10-9-11-13-21/h9-13,17-20,22-23,25-26H,14-16H2,1-8H3/t22-,23+,25-,26-/m1/s1