2-[6-(phenylcarbonyl)-1,3-benzodioxol-5-yl]ethanoic acid

Systemtic Name: 2-[6-(phenylcarbonyl)-1,3-benzodioxol-5-yl]ethanoic acid Openeye Name: 2-(6-benzoyl-1,3-benzodioxol-5-yl)acetic acid CAS Name: 2-(6-benzoyl-1,3-benzodioxol-5-yl)acetic acid IUPAC Name: 2-(6-benzoyl-1,3-benzodioxol-5-yl)acetic acid Traditional Name: 2-(6-benzoyl-1,3-benzodioxol-5-yl)acetic acid Formula: C16H12O5 MolecularWeight: 284.26348

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CC(=O)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CC(=O)O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H12O5/c17-15(18)7-11-6-13-14(21-9-20-13)8-12(11)16(19)10-4-2-1-3-5-10/h1-6,8H,7,9H2,(H,17,18)