(4-ethanoylphenyl) 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (4-ethanoylphenyl) 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: (4-acetylphenyl) 5-bromo-3-methyl-benzofuran-2-carboxylate CAS Name: 5-bromo-3-methyl-2-benzofurancarboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 5-bromo-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-methyl-coumarilic acid (4-acetylphenyl) ester Formula: C18H13BrO4 MolecularWeight: 373.19742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)OC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)OC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C18H13BrO4/c1-10-15-9-13(19)5-8-16(15)23-17(10)18(21)22-14-6-3-12(4-7-14)11(2)20/h3-9H,1-2H3