[(4S,5R)-5-oxidanyl-4,6-bis(phenylmethoxy)hexyl] 2,2-dimethylpropanoate

Systemtic Name: [(4S,5R)-5-oxidanyl-4,6-bis(phenylmethoxy)hexyl] 2,2-dimethylpropanoate Openeye Name: [(4S,5R)-4,6-dibenzyloxy-5-hydroxy-hexyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(4S,5R)-5-hydroxy-4,6-bis(phenylmethoxy)hexyl] ester IUPAC Name: [(4S,5R)-5-hydroxy-4,6-bis(phenylmethoxy)hexyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(4S,5R)-4,6-dibenzoxy-5-hydroxy-hexyl] ester Formula: C25H34O5 MolecularWeight: 414.53446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCCCC(C(COCC1=CC=CC=C1)O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)OCCC[C@@H]([C@@H](COCC1=CC=CC=C1)O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H34O5/c1-25(2,3)24(27)29-16-10-15-23(30-18-21-13-8-5-9-14-21)22(26)19-28-17-20-11-6-4-7-12-20/h4-9,11-14,22-23,26H,10,15-19H2,1-3H3/t22-,23+/m1/s1