ethyl 5-bromanyl-3-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-bromanyl-3-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-bromo-3-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]benzofuran-2-carboxylate CAS Name: 5-bromo-3-[[(2E,4E)-1-oxohexa-2,4-dienoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-3-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]coumarilic acid ethyl ester Formula: C18H17BrO5 MolecularWeight: 393.22858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrO5/c1-3-5-6-7-16(20)23-11-14-13-10-12(19)8-9-15(13)24-17(14)18(21)22-4-2/h3,5-10H,4,11H2,1-2H3/b5-3+,7-6+