ethyl (2S,3R)-3-(3-dodecylphenyl)-2,3-bis(oxidanyl)propanoate

Systemtic Name: ethyl (2S,3R)-3-(3-dodecylphenyl)-2,3-bis(oxidanyl)propanoate Openeye Name: ethyl (2S,3R)-3-(3-dodecylphenyl)-2,3-dihydroxy-propanoate CAS Name: (2S,3R)-3-(3-dodecylphenyl)-2,3-dihydroxypropanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-3-(3-dodecylphenyl)-2,3-dihydroxypropanoate Traditional Name: (2S,3R)-2,3-dihydroxy-3-(3-laurylphenyl)propionic acid ethyl ester Formula: C23H38O4 MolecularWeight: 378.54542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=CC=C1)C(C(C(=O)OCC)O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=CC=C1)[C@H]([C@@H](C(=O)OCC)O)O

InChI

InChI=1S/C23H38O4/c1-3-5-6-7-8-9-10-11-12-13-15-19-16-14-17-20(18-19)21(24)22(25)23(26)27-4-2/h14,16-18,21-22,24-25H,3-13,15H2,1-2H3/t21-,22+/m1/s1