(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2,5-dimethylfuran-3-carboxylate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2,5-dimethylfuran-3-carboxylate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2,5-dimethylfuran-3-carboxylate CAS Name: 2,5-dimethyl-3-furancarboxylic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2,5-dimethylfuran-3-carboxylate Traditional Name: 2,5-dimethylfuran-3-carboxylic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C16H15BrO5 MolecularWeight: 367.1913

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)OCC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)OCC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C16H15BrO5/c1-9-5-12(10(2)22-9)16(18)21-8-11-6-14-15(7-13(11)17)20-4-3-19-14/h5-7H,3-4,8H2,1-2H3