phenyl 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: phenyl 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: phenyl 5-bromo-3-methyl-benzofuran-2-carboxylate CAS Name: 5-bromo-3-methyl-2-benzofurancarboxylic acid phenyl ester IUPAC Name: phenyl 5-bromo-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-methyl-coumarilic acid phenyl ester Formula: C16H11BrO3 MolecularWeight: 331.16074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrO3/c1-10-13-9-11(17)7-8-14(13)20-15(10)16(18)19-12-5-3-2-4-6-12/h2-9H,1H3