ethyl (3S,4R)-2,2,4-trimethyl-3-oxidanyl-5-phenylmethoxy-pentanoate

Systemtic Name: ethyl (3S,4R)-2,2,4-trimethyl-3-oxidanyl-5-phenylmethoxy-pentanoate Openeye Name: ethyl (3S,4R)-5-benzyloxy-3-hydroxy-2,2,4-trimethyl-pentanoate CAS Name: (3S,4R)-3-hydroxy-2,2,4-trimethyl-5-phenylmethoxypentanoic acid ethyl ester IUPAC Name: ethyl (3S,4R)-3-hydroxy-2,2,4-trimethyl-5-phenylmethoxypentanoate Traditional Name: (3S,4R)-5-benzoxy-3-hydroxy-2,2,4-trimethyl-valeric acid ethyl ester Formula: C17H26O4 MolecularWeight: 294.38594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)C(C(C)COCC1=CC=CC=C1)O

Isomeric SMILES

CCOC(=O)C(C)(C)[C@H]([C@H](C)COCC1=CC=CC=C1)O

InChI

InChI=1S/C17H26O4/c1-5-21-16(19)17(3,4)15(18)13(2)11-20-12-14-9-7-6-8-10-14/h6-10,13,15,18H,5,11-12H2,1-4H3/t13-,15+/m1/s1