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

Systemtic Name: 2-(1,3-benzodioxol-5-yloxymethyl)benzoic acid Openeye Name: 2-(1,3-benzodioxol-5-yloxymethyl)benzoic acid CAS Name: 2-(1,3-benzodioxol-5-yloxymethyl)benzoic acid IUPAC Name: 2-(1,3-benzodioxol-5-yloxymethyl)benzoic acid Traditional Name: 2-(1,3-benzodioxol-5-yloxymethyl)benzoic acid Formula: C15H12O5 MolecularWeight: 272.25278

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C15H12O5/c16-15(17)12-4-2-1-3-10(12)8-18-11-5-6-13-14(7-11)20-9-19-13/h1-7H,8-9H2,(H,16,17)