[(2S,3R,4S)-3-acetyloxy-4-dodecyl-1-ethanoyl-azetidin-2-yl]methyl ethanoate

Systemtic Name: [(2S,3R,4S)-3-acetyloxy-4-dodecyl-1-ethanoyl-azetidin-2-yl]methyl ethanoate Openeye Name: [(2S,3R,4S)-3-acetoxy-1-acetyl-4-dodecyl-azetidin-2-yl]methyl acetate CAS Name: acetic acid [(2S,3R,4S)-1-acetyl-3-acetyloxy-4-dodecyl-2-azetidinyl]methyl ester IUPAC Name: [(2S,3R,4S)-1-acetyl-3-acetyloxy-4-dodecylazetidin-2-yl]methyl acetate Traditional Name: acetic acid [(2S,3R,4S)-3-acetoxy-1-acetyl-4-lauryl-azetidin-2-yl]methyl ester Formula: C22H39NO5 MolecularWeight: 397.54876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1C(C(N1C(=O)C)COC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCC[C@H]1[C@H]([C@@H](N1C(=O)C)COC(=O)C)OC(=O)C

InChI

InChI=1S/C22H39NO5/c1-5-6-7-8-9-10-11-12-13-14-15-20-22(28-19(4)26)21(16-27-18(3)25)23(20)17(2)24/h20-22H,5-16H2,1-4H3/t20-,21-,22+/m0/s1