(4-bromanyl-2,5-dimethoxy-phenyl)methyl 3,5-dimethoxybenzoate

Systemtic Name: (4-bromanyl-2,5-dimethoxy-phenyl)methyl 3,5-dimethoxybenzoate Openeye Name: (4-bromo-2,5-dimethoxy-phenyl)methyl 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic acid (4-bromo-2,5-dimethoxyphenyl)methyl ester IUPAC Name: (4-bromo-2,5-dimethoxyphenyl)methyl 3,5-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid (4-bromo-2,5-dimethoxy-benzyl) ester Formula: C18H19BrO6 MolecularWeight: 411.24386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)OCC2=CC(=C(C=C2OC)Br)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)OCC2=CC(=C(C=C2OC)Br)OC)OC

InChI

InChI=1S/C18H19BrO6/c1-21-13-5-11(6-14(8-13)22-2)18(20)25-10-12-7-17(24-4)15(19)9-16(12)23-3/h5-9H,10H2,1-4H3