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

Systemtic Name: [(2E,6E)-3,7-dimethyl-8-(3-methylphenyl)octa-2,6-dienoxy]methyl 2-bromanylethanoate Openeye Name: [(2E,6E)-3,7-dimethyl-8-(m-tolyl)octa-2,6-dienoxy]methyl 2-bromoacetate CAS Name: 2-bromoacetic acid [(2E,6E)-3,7-dimethyl-8-(3-methylphenyl)octa-2,6-dienoxy]methyl ester IUPAC Name: [(2E,6E)-3,7-dimethyl-8-(3-methylphenyl)octa-2,6-dienoxy]methyl 2-bromoacetate Traditional Name: 2-bromoacetic acid [(2E,6E)-3,7-dimethyl-8-(m-tolyl)octa-2,6-dienoxy]methyl ester Formula: C20H27BrO3 MolecularWeight: 395.33058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27BrO3/c1-16(10-11-23-15-24-20(22)14-21)6-4-7-17(2)12-19-9-5-8-18(3)13-19/h5,7-10,13H,4,6,11-12,14-15H2,1-3H3/b16-10+,17-7+