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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)benzoate Openeye Name: 3-(1,3-benzodioxol-5-yl)benzoate CAS Name: 3-(1,3-benzodioxol-5-yl)benzoate IUPAC Name: 3-(1,3-benzodioxol-5-yl)benzoate Traditional Name: 3-(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=C3)C(=O)[O-]

Isomeric SMILES

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

InChI

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