[(4E,8E)-12-bromanyl-5,9,13-trimethyl-13-oxidanyl-tetradeca-4,8-dienyl] ethanoate

Systemtic Name: [(4E,8E)-12-bromanyl-5,9,13-trimethyl-13-oxidanyl-tetradeca-4,8-dienyl] ethanoate Openeye Name: [(4E,8E)-12-bromo-13-hydroxy-5,9,13-trimethyl-tetradeca-4,8-dienyl] acetate CAS Name: acetic acid [(4E,8E)-12-bromo-13-hydroxy-5,9,13-trimethyltetradeca-4,8-dienyl] ester IUPAC Name: [(4E,8E)-12-bromo-13-hydroxy-5,9,13-trimethyltetradeca-4,8-dienyl] acetate Traditional Name: acetic acid [(4E,8E)-12-bromo-13-hydroxy-5,9,13-trimethyl-tetradeca-4,8-dienyl] ester Formula: C19H33BrO3 MolecularWeight: 389.36752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCCOC(=O)C)CCC=C(C)CCC(C(C)(C)O)Br

Isomeric SMILES

C/C(=C\CCCOC(=O)C)/CC/C=C(\C)/CCC(C(C)(C)O)Br

InChI

InChI=1S/C19H33BrO3/c1-15(9-6-7-14-23-17(3)21)10-8-11-16(2)12-13-18(20)19(4,5)22/h9,11,18,22H,6-8,10,12-14H2,1-5H3/b15-9+,16-11+