(6-bromanyl-1,3-benzodioxol-5-yl)methyl 2-(3,4-dimethoxyphenyl)ethanoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 2-(3,4-dimethoxyphenyl)ethanoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2-(3,4-dimethoxyphenyl)acetate CAS Name: 2-(3,4-dimethoxyphenyl)acetic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2-(3,4-dimethoxyphenyl)acetate Traditional Name: 2-(3,4-dimethoxyphenyl)acetic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C18H17BrO6 MolecularWeight: 409.22798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrO6/c1-21-14-4-3-11(5-15(14)22-2)6-18(20)23-9-12-7-16-17(8-13(12)19)25-10-24-16/h3-5,7-8H,6,9-10H2,1-2H3