1,3-benzodioxol-5-yl 3-bromanyl-4-ethoxy-5-methoxy-benzoate

Systemtic Name: 1,3-benzodioxol-5-yl 3-bromanyl-4-ethoxy-5-methoxy-benzoate Openeye Name: 1,3-benzodioxol-5-yl 3-bromo-4-ethoxy-5-methoxy-benzoate CAS Name: 3-bromo-4-ethoxy-5-methoxybenzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 3-bromo-4-ethoxy-5-methoxybenzoate Traditional Name: 3-bromo-4-ethoxy-5-methoxy-benzoic acid 1,3-benzodioxol-5-yl ester Formula: C17H15BrO6 MolecularWeight: 395.2014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)OC2=CC3=C(C=C2)OCO3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)OC2=CC3=C(C=C2)OCO3)OC

InChI

InChI=1S/C17H15BrO6/c1-3-21-16-12(18)6-10(7-15(16)20-2)17(19)24-11-4-5-13-14(8-11)23-9-22-13/h4-8H,3,9H2,1-2H3