ethyl (4R,5S)-5-[(10S)-10-acetyloxy-11-bromanyl-undecyl]-2,2-dimethyl-1,3-dioxolane-4-carboxylate

Systemtic Name: ethyl (4R,5S)-5-[(10S)-10-acetyloxy-11-bromanyl-undecyl]-2,2-dimethyl-1,3-dioxolane-4-carboxylate Openeye Name: ethyl (4R,5S)-5-[(10S)-10-acetoxy-11-bromo-undecyl]-2,2-dimethyl-1,3-dioxolane-4-carboxylate CAS Name: (4R,5S)-5-[(10S)-10-acetyloxy-11-bromoundecyl]-2,2-dimethyl-1,3-dioxolane-4-carboxylic acid ethyl ester IUPAC Name: ethyl (4R,5S)-5-[(10S)-10-acetyloxy-11-bromoundecyl]-2,2-dimethyl-1,3-dioxolane-4-carboxylate Traditional Name: (4R,5S)-5-[(10S)-10-acetoxy-11-bromo-undecyl]-2,2-dimethyl-1,3-dioxolane-4-carboxylic acid ethyl ester Formula: C21H37BrO6 MolecularWeight: 465.41888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(OC(O1)(C)C)CCCCCCCCCC(CBr)OC(=O)C

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](OC(O1)(C)C)CCCCCCCCC[C@@H](CBr)OC(=O)C

InChI

InChI=1S/C21H37BrO6/c1-5-25-20(24)19-18(27-21(3,4)28-19)14-12-10-8-6-7-9-11-13-17(15-22)26-16(2)23/h17-19H,5-15H2,1-4H3/t17-,18-,19+/m0/s1