3-[[2-bromanyl-4-(2-methylbutan-2-yl)phenoxy]methyl]benzoate

Systemtic Name: 3-[[2-bromanyl-4-(2-methylbutan-2-yl)phenoxy]methyl]benzoate Openeye Name: 3-[[2-bromo-4-(1,1-dimethylpropyl)phenoxy]methyl]benzoate CAS Name: 3-[[2-bromo-4-(2-methylbutan-2-yl)phenoxy]methyl]benzoate IUPAC Name: 3-[[2-bromo-4-(2-methylbutan-2-yl)phenoxy]methyl]benzoate Traditional Name: 3-[(4-tert-amyl-2-bromo-phenoxy)methyl]benzoate Formula: C19H20BrO3- MolecularWeight: 376.2643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)[O-])Br

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)[O-])Br

InChI

InChI=1S/C19H21BrO3/c1-4-19(2,3)15-8-9-17(16(20)11-15)23-12-13-6-5-7-14(10-13)18(21)22/h5-11H,4,12H2,1-3H3,(H,21,22)/p-1