ethyl 6-bromanyl-5-cyclohexylcarbonyloxy-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-5-cyclohexylcarbonyloxy-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-5-(cyclohexanecarbonyloxy)-2-phenyl-benzofuran-3-carboxylate CAS Name: 6-bromo-5-[cyclohexyl(oxo)methoxy]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-5-(cyclohexanecarbonyloxy)-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-5-(cyclohexanecarbonyloxy)-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C24H23BrO5 MolecularWeight: 471.34042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(=O)C3CCCCC3)Br)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(=O)C3CCCCC3)Br)C4=CC=CC=C4

InChI

InChI=1S/C24H23BrO5/c1-2-28-24(27)21-17-13-20(30-23(26)16-11-7-4-8-12-16)18(25)14-19(17)29-22(21)15-9-5-3-6-10-15/h3,5-6,9-10,13-14,16H,2,4,7-8,11-12H2,1H3