S-dodecyl (2R,3R)-3-methoxy-2,3,4-trimethyl-pentanethioate

Systemtic Name: S-dodecyl (2R,3R)-3-methoxy-2,3,4-trimethyl-pentanethioate Openeye Name: S-dodecyl (2R,3R)-3-methoxy-2,3,4-trimethyl-pentanethioate CAS Name: (2R,3R)-3-methoxy-2,3,4-trimethylpentanethioic acid S-dodecyl ester IUPAC Name: S-dodecyl (2R,3R)-3-methoxy-2,3,4-trimethylpentanethioate Traditional Name: (2R,3R)-3-methoxy-2,3,4-trimethyl-pentanethioic acid S-lauryl ester Formula: C21H42O2S MolecularWeight: 358.62198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(=O)C(C)C(C)(C(C)C)OC

Isomeric SMILES

CCCCCCCCCCCCSC(=O)[C@H](C)[C@@](C)(C(C)C)OC

InChI

InChI=1S/C21H42O2S/c1-7-8-9-10-11-12-13-14-15-16-17-24-20(22)19(4)21(5,23-6)18(2)3/h18-19H,7-17H2,1-6H3/t19-,21+/m0/s1