[(2E,6E)-8-bromanyl-3,7-dimethyl-octa-2,6-dienyl] benzoate

Systemtic Name: [(2E,6E)-8-bromanyl-3,7-dimethyl-octa-2,6-dienyl] benzoate Openeye Name: [(2E,6E)-8-bromo-3,7-dimethyl-octa-2,6-dienyl] benzoate CAS Name: benzoic acid [(2E,6E)-8-bromo-3,7-dimethylocta-2,6-dienyl] ester IUPAC Name: [(2E,6E)-8-bromo-3,7-dimethylocta-2,6-dienyl] benzoate Traditional Name: benzoic acid [(2E,6E)-8-bromo-3,7-dimethyl-octa-2,6-dienyl] ester Formula: C17H21BrO2 MolecularWeight: 337.25144

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC(=O)C1=CC=CC=C1)CCC=C(C)CBr

Isomeric SMILES

C/C(=C\COC(=O)C1=CC=CC=C1)/CC/C=C(\C)/CBr

InChI

InChI=1S/C17H21BrO2/c1-14(7-6-8-15(2)13-18)11-12-20-17(19)16-9-4-3-5-10-16/h3-5,8-11H,6-7,12-13H2,1-2H3/b14-11+,15-8+