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

Systemtic Name: [(4S,5R)-5-benzamido-4-oxidanyl-6-phenylmethoxy-hexyl] 2,2-dimethylpropanoate Openeye Name: [(4S,5R)-5-benzamido-6-benzyloxy-4-hydroxy-hexyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(4S,5R)-5-benzamido-4-hydroxy-6-phenylmethoxyhexyl] ester IUPAC Name: [(4S,5R)-5-benzamido-4-hydroxy-6-phenylmethoxyhexyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(4S,5R)-5-benzamido-6-benzoxy-4-hydroxy-hexyl] ester Formula: C25H33NO5 MolecularWeight: 427.53322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33NO5/c1-25(2,3)24(29)31-16-10-15-22(27)21(18-30-17-19-11-6-4-7-12-19)26-23(28)20-13-8-5-9-14-20/h4-9,11-14,21-22,27H,10,15-18H2,1-3H3,(H,26,28)/t21-,22+/m1/s1