2-(1,3-benzodioxol-5-yl)benzoate

Systemtic Name: 2-(1,3-benzodioxol-5-yl)benzoate Openeye Name: 2-(1,3-benzodioxol-5-yl)benzoate CAS Name: 2-(1,3-benzodioxol-5-yl)benzoate IUPAC Name: 2-(1,3-benzodioxol-5-yl)benzoate Traditional Name: 2-(1,3-benzodioxol-5-yl)benzoate Formula: C14H9O4- MolecularWeight: 241.21886

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC=CC=C3C(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC=CC=C3C(=O)[O-]

InChI

InChI=1S/C14H10O4/c15-14(16)11-4-2-1-3-10(11)9-5-6-12-13(7-9)18-8-17-12/h1-7H,8H2,(H,15,16)/p-1