2-[3-(carboxymethylperoxy)-2-oxidanylidene-1-benzofuran-3-yl]ethanoic acid

Systemtic Name: 2-[3-(carboxymethylperoxy)-2-oxidanylidene-1-benzofuran-3-yl]ethanoic acid Openeye Name: 2-[3-(carboxymethylperoxy)-2-oxo-benzofuran-3-yl]acetic acid CAS Name: 2-[3-(carboxymethyldioxy)-2-oxo-3-benzofuranyl]acetic acid IUPAC Name: 2-[3-(carboxymethylperoxy)-2-oxo-1-benzofuran-3-yl]acetic acid Traditional Name: 2-[3-(carboxymethylperoxy)-2-keto-coumaran-3-yl]acetic acid Formula: C12H10O8 MolecularWeight: 282.203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(=O)O2)(CC(=O)O)OOCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C(=O)O2)(CC(=O)O)OOCC(=O)O

InChI

InChI=1S/C12H10O8/c13-9(14)5-12(20-18-6-10(15)16)7-3-1-2-4-8(7)19-11(12)17/h1-4H,5-6H2,(H,13,14)(H,15,16)