[(1R,2R,3S,4S,5R)-5-acetamido-2,4-diacetyloxy-3-phenylmethoxy-cyclohexyl]methyl benzoate

Systemtic Name: [(1R,2R,3S,4S,5R)-5-acetamido-2,4-diacetyloxy-3-phenylmethoxy-cyclohexyl]methyl benzoate Openeye Name: [(1R,2R,3S,4S,5R)-5-acetamido-2,4-diacetoxy-3-benzyloxy-cyclohexyl]methyl benzoate CAS Name: benzoic acid [(1R,2R,3S,4S,5R)-5-acetamido-2,4-diacetyloxy-3-phenylmethoxycyclohexyl]methyl ester IUPAC Name: [(1R,2R,3S,4S,5R)-5-acetamido-2,4-diacetyloxy-3-phenylmethoxycyclohexyl]methyl benzoate Traditional Name: benzoic acid [(1R,2R,3S,4S,5R)-5-acetamido-2,4-diacetoxy-3-benzoxy-cyclohexyl]methyl ester Formula: C27H31NO8 MolecularWeight: 497.53694

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CC(C(C(C1OC(=O)C)OCC2=CC=CC=C2)OC(=O)C)COC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)N[C@@H]1C[C@@H]([C@H]([C@@H]([C@H]1OC(=O)C)OCC2=CC=CC=C2)OC(=O)C)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H31NO8/c1-17(29)28-23-14-22(16-34-27(32)21-12-8-5-9-13-21)24(35-18(2)30)26(25(23)36-19(3)31)33-15-20-10-6-4-7-11-20/h4-13,22-26H,14-16H2,1-3H3,(H,28,29)/t22-,23-,24-,25+,26+/m1/s1