3-[4,5-bis(oxidanylidene)-3-phenyl-oxolan-2-yl]propanoic acid

Systemtic Name: 3-[4,5-bis(oxidanylidene)-3-phenyl-oxolan-2-yl]propanoic acid Openeye Name: 3-(4,5-dioxo-3-phenyl-tetrahydrofuran-2-yl)propanoic acid CAS Name: 3-(4,5-dioxo-3-phenyl-2-oxolanyl)propanoic acid IUPAC Name: 3-(4,5-dioxo-3-phenyloxolan-2-yl)propanoic acid Traditional Name: 3-(4,5-diketo-3-phenyl-tetrahydrofuran-2-yl)propionic acid Formula: C13H12O5 MolecularWeight: 248.23138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(OC(=O)C2=O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2C(OC(=O)C2=O)CCC(=O)O

InChI

InChI=1S/C13H12O5/c14-10(15)7-6-9-11(12(16)13(17)18-9)8-4-2-1-3-5-8/h1-5,9,11H,6-7H2,(H,14,15)