ditert-butyl (1S,2S,5R)-4-oxidanylidene-5-phenylmethoxy-cyclohexane-1,2-dicarboxylate

Systemtic Name: ditert-butyl (1S,2S,5R)-4-oxidanylidene-5-phenylmethoxy-cyclohexane-1,2-dicarboxylate Openeye Name: ditert-butyl (1S,2S,4R)-4-benzyloxy-5-oxo-cyclohexane-1,2-dicarboxylate CAS Name: (1S,2S,5R)-4-oxo-5-phenylmethoxycyclohexane-1,2-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl (1S,2S,5R)-4-oxo-5-phenylmethoxycyclohexane-1,2-dicarboxylate Traditional Name: (1S,2S,4R)-4-benzoxy-5-keto-cyclohexane-1,2-dicarboxylic acid ditert-butyl ester Formula: C23H32O6 MolecularWeight: 404.49658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CC(C(=O)CC1C(=O)OC(C)(C)C)OCC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C23H32O6/c1-22(2,3)28-20(25)16-12-18(24)19(27-14-15-10-8-7-9-11-15)13-17(16)21(26)29-23(4,5)6/h7-11,16-17,19H,12-14H2,1-6H3/t16-,17-,19+/m0/s1