[(2R,3R)-2-acetamido-3-acetyloxy-7,8-bis(methylsulfanyl)tetradecyl] ethanoate

Systemtic Name: [(2R,3R)-2-acetamido-3-acetyloxy-7,8-bis(methylsulfanyl)tetradecyl] ethanoate Openeye Name: [(2R,3R)-2-acetamido-3-acetoxy-7,8-bis(methylsulfanyl)tetradecyl] acetate CAS Name: acetic acid [(2R,3R)-2-acetamido-3-acetyloxy-7,8-bis(methylthio)tetradecyl] ester IUPAC Name: [(2R,3R)-2-acetamido-3-acetyloxy-7,8-bis(methylsulfanyl)tetradecyl] acetate Traditional Name: acetic acid [(2R,3R)-2-acetamido-3-acetoxy-7,8-bis(methylthio)tetradecyl] ester Formula: C22H41NO5S2 MolecularWeight: 463.69464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(CCCC(C(COC(=O)C)NC(=O)C)OC(=O)C)SC)SC

Isomeric SMILES

CCCCCCC(C(CCC[C@H]([C@@H](COC(=O)C)NC(=O)C)OC(=O)C)SC)SC

InChI

InChI=1S/C22H41NO5S2/c1-7-8-9-10-13-21(29-5)22(30-6)14-11-12-20(28-18(4)26)19(23-16(2)24)15-27-17(3)25/h19-22H,7-15H2,1-6H3,(H,23,24)/t19-,20-,21?,22?/m1/s1