(6-bromanyl-1,3-benzodioxol-5-yl)methyl 2,6-dimethoxybenzoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 2,6-dimethoxybenzoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2,6-dimethoxybenzoate CAS Name: 2,6-dimethoxybenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2,6-dimethoxybenzoate Traditional Name: 2,6-dimethoxybenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C17H15BrO6 MolecularWeight: 395.2014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)OCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)OCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C17H15BrO6/c1-20-12-4-3-5-13(21-2)16(12)17(19)22-8-10-6-14-15(7-11(10)18)24-9-23-14/h3-7H,8-9H2,1-2H3