S-ethyl (2R,3R)-2-methyl-3-oxidanyl-tetradecanethioate

Systemtic Name: S-ethyl (2R,3R)-2-methyl-3-oxidanyl-tetradecanethioate Openeye Name: S-ethyl (2R,3R)-3-hydroxy-2-methyl-tetradecanethioate CAS Name: (2R,3R)-3-hydroxy-2-methyltetradecanethioic acid S-ethyl ester IUPAC Name: S-ethyl (2R,3R)-3-hydroxy-2-methyltetradecanethioate Traditional Name: (2R,3R)-3-hydroxy-2-methyl-tetradecanethioic acid S-ethyl ester Formula: C17H34O2S MolecularWeight: 302.51566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C(C)C(=O)SCC)O

Isomeric SMILES

CCCCCCCCCCC[C@H]([C@@H](C)C(=O)SCC)O

InChI

InChI=1S/C17H34O2S/c1-4-6-7-8-9-10-11-12-13-14-16(18)15(3)17(19)20-5-2/h15-16,18H,4-14H2,1-3H3/t15-,16-/m1/s1