phenyl 3-bromanyl-4-(2-methylpropoxy)benzoate

Systemtic Name: phenyl 3-bromanyl-4-(2-methylpropoxy)benzoate Openeye Name: phenyl 3-bromo-4-isobutoxy-benzoate CAS Name: 3-bromo-4-(2-methylpropoxy)benzoic acid phenyl ester IUPAC Name: phenyl 3-bromo-4-(2-methylpropoxy)benzoate Traditional Name: 3-bromo-4-isobutoxy-benzoic acid phenyl ester Formula: C17H17BrO3 MolecularWeight: 349.21908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2)Br

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2)Br

InChI

InChI=1S/C17H17BrO3/c1-12(2)11-20-16-9-8-13(10-15(16)18)17(19)21-14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3