(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-methoxy-2-oxidanyl-benzoate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-methoxy-2-oxidanyl-benzoate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-hydroxy-3-methoxy-benzoate CAS Name: 2-hydroxy-3-methoxybenzoic 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-hydroxy-3-methoxybenzoate Traditional Name: 2-hydroxy-3-methoxy-benzoic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C17H15BrO6 MolecularWeight: 395.2014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)C(=O)OCC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

COC1=CC=CC(=C1O)C(=O)OCC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C17H15BrO6/c1-21-13-4-2-3-11(16(13)19)17(20)24-9-10-7-14-15(8-12(10)18)23-6-5-22-14/h2-4,7-8,19H,5-6,9H2,1H3