(6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-methoxybenzoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-methoxybenzoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C16H13BrO5 MolecularWeight: 365.17542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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