methyl 4-[(6-bromanyl-1,3-benzodioxol-5-yl)methoxy]benzoate

Systemtic Name: methyl 4-[(6-bromanyl-1,3-benzodioxol-5-yl)methoxy]benzoate Openeye Name: methyl 4-[(6-bromo-1,3-benzodioxol-5-yl)methoxy]benzoate CAS Name: 4-[(6-bromo-1,3-benzodioxol-5-yl)methoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[(6-bromo-1,3-benzodioxol-5-yl)methoxy]benzoate Traditional Name: 4-[(6-bromo-1,3-benzodioxol-5-yl)methoxy]benzoic acid methyl ester Formula: C16H13BrO5 MolecularWeight: 365.17542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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