(2-tert-butyl-4-methyl-phenyl) 5-bromanylfuran-2-carboxylate

Systemtic Name: (2-tert-butyl-4-methyl-phenyl) 5-bromanylfuran-2-carboxylate Openeye Name: (2-tert-butyl-4-methyl-phenyl) 5-bromofuran-2-carboxylate CAS Name: 5-bromo-2-furancarboxylic acid (2-tert-butyl-4-methylphenyl) ester IUPAC Name: (2-tert-butyl-4-methylphenyl) 5-bromofuran-2-carboxylate Traditional Name: 5-bromofuran-2-carboxylic acid (2-tert-butyl-4-methyl-phenyl) ester Formula: C16H17BrO3 MolecularWeight: 337.20838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=CC=C(O2)Br)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=CC=C(O2)Br)C(C)(C)C

InChI

InChI=1S/C16H17BrO3/c1-10-5-6-12(11(9-10)16(2,3)4)20-15(18)13-7-8-14(17)19-13/h5-9H,1-4H3