2-(1,3-benzodioxol-5-yloxymethyl)-5-bromanyl-benzoic acid

Systemtic Name: 2-(1,3-benzodioxol-5-yloxymethyl)-5-bromanyl-benzoic acid Openeye Name: 2-(1,3-benzodioxol-5-yloxymethyl)-5-bromo-benzoic acid CAS Name: 2-(1,3-benzodioxol-5-yloxymethyl)-5-bromobenzoic acid IUPAC Name: 2-(1,3-benzodioxol-5-yloxymethyl)-5-bromobenzoic acid Traditional Name: 2-(1,3-benzodioxol-5-yloxymethyl)-5-bromo-benzoic acid Formula: C15H11BrO5 MolecularWeight: 351.14884

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCC3=C(C=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCC3=C(C=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C15H11BrO5/c16-10-2-1-9(12(5-10)15(17)18)7-19-11-3-4-13-14(6-11)21-8-20-13/h1-6H,7-8H2,(H,17,18)