(3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 5-bromanylfuran-2-carboxylate

Systemtic Name: (3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 5-bromanylfuran-2-carboxylate Openeye Name: (3-acetyl-2,4,6-trimethyl-phenyl)methyl 5-bromofuran-2-carboxylate CAS Name: 5-bromo-2-furancarboxylic acid (3-acetyl-2,4,6-trimethylphenyl)methyl ester IUPAC Name: (3-acetyl-2,4,6-trimethylphenyl)methyl 5-bromofuran-2-carboxylate Traditional Name: 5-bromofuran-2-carboxylic acid (3-acetyl-2,4,6-trimethyl-benzyl) ester Formula: C17H17BrO4 MolecularWeight: 365.21848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=CC=C(O2)Br)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=CC=C(O2)Br)C

InChI

InChI=1S/C17H17BrO4/c1-9-7-10(2)16(12(4)19)11(3)13(9)8-21-17(20)14-5-6-15(18)22-14/h5-7H,8H2,1-4H3