1,3-benzodioxol-5-ylmethyl 3-bromanyl-4-methoxy-benzoate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl 3-bromanyl-4-methoxy-benzoate Openeye Name: 1,3-benzodioxol-5-ylmethyl 3-bromo-4-methoxy-benzoate CAS Name: 3-bromo-4-methoxybenzoic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl 3-bromo-4-methoxybenzoate Traditional Name: 3-bromo-4-methoxy-benzoic acid piperonyl ester Formula: C16H13BrO5 MolecularWeight: 365.17542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC2=CC3=C(C=C2)OCO3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC2=CC3=C(C=C2)OCO3)Br

InChI

InChI=1S/C16H13BrO5/c1-19-13-5-3-11(7-12(13)17)16(18)20-8-10-2-4-14-15(6-10)22-9-21-14/h2-7H,8-9H2,1H3