ethyl 5-bromanyl-3-[[(1S,2S)-2-methylcyclopropyl]carbonyloxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-bromanyl-3-[[(1S,2S)-2-methylcyclopropyl]carbonyloxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-bromo-3-[[(1S,2S)-2-methylcyclopropanecarbonyl]oxymethyl]benzofuran-2-carboxylate CAS Name: 5-bromo-3-[[[(1S,2S)-2-methylcyclopropyl]-oxomethoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-3-[[(1S,2S)-2-methylcyclopropanecarbonyl]oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-[[(1S,2S)-2-methylcyclopropanecarbonyl]oxymethyl]coumarilic acid ethyl ester Formula: C17H17BrO5 MolecularWeight: 381.21788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)C3CC3C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)[C@H]3C[C@@H]3C

InChI

InChI=1S/C17H17BrO5/c1-3-21-17(20)15-13(8-22-16(19)11-6-9(11)2)12-7-10(18)4-5-14(12)23-15/h4-5,7,9,11H,3,6,8H2,1-2H3/t9-,11-/m0/s1