[(2E,6E)-3,7-dimethyl-8-(3-methylphenyl)octa-2,6-dienyl] 2-bromanylethanoate

Systemtic Name: [(2E,6E)-3,7-dimethyl-8-(3-methylphenyl)octa-2,6-dienyl] 2-bromanylethanoate Openeye Name: [(2E,6E)-3,7-dimethyl-8-(m-tolyl)octa-2,6-dienyl] 2-bromoacetate CAS Name: 2-bromoacetic acid [(2E,6E)-3,7-dimethyl-8-(3-methylphenyl)octa-2,6-dienyl] ester IUPAC Name: [(2E,6E)-3,7-dimethyl-8-(3-methylphenyl)octa-2,6-dienyl] 2-bromoacetate Traditional Name: 2-bromoacetic acid [(2E,6E)-3,7-dimethyl-8-(m-tolyl)octa-2,6-dienyl] ester Formula: C19H25BrO2 MolecularWeight: 365.3046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(=CCCC(=CCOC(=O)CBr)C)C

Isomeric SMILES

CC1=CC(=CC=C1)C/C(=C/CC/C(=C/COC(=O)CBr)/C)/C

InChI

InChI=1S/C19H25BrO2/c1-15(10-11-22-19(21)14-20)6-4-7-16(2)12-18-9-5-8-17(3)13-18/h5,7-10,13H,4,6,11-12,14H2,1-3H3/b15-10+,16-7+