ethyl (3S,4S)-2,2-dimethyl-3,4-bis(oxidanyl)-5-phenyl-hexanoate

Systemtic Name: ethyl (3S,4S)-2,2-dimethyl-3,4-bis(oxidanyl)-5-phenyl-hexanoate Openeye Name: ethyl (3S,4S)-3,4-dihydroxy-2,2-dimethyl-5-phenyl-hexanoate CAS Name: (3S,4S)-3,4-dihydroxy-2,2-dimethyl-5-phenylhexanoic acid ethyl ester IUPAC Name: ethyl (3S,4S)-3,4-dihydroxy-2,2-dimethyl-5-phenylhexanoate Traditional Name: (3S,4S)-3,4-dihydroxy-2,2-dimethyl-5-phenyl-hexanoic acid ethyl ester Formula: C16H24O4 MolecularWeight: 280.35936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24O4/c1-5-20-15(19)16(3,4)14(18)13(17)11(2)12-9-7-6-8-10-12/h6-11,13-14,17-18H,5H2,1-4H3/t11?,13-,14+/m0/s1