3-[2,4-bis(oxidanylidene)-1,5-benzodioxepin-7-yl]propanoic acid

Systemtic Name: 3-[2,4-bis(oxidanylidene)-1,5-benzodioxepin-7-yl]propanoic acid Openeye Name: 3-(2,4-dioxo-1,5-benzodioxepin-7-yl)propanoic acid CAS Name: 3-(2,4-dioxo-1,5-benzodioxepin-7-yl)propanoic acid IUPAC Name: 3-(2,4-dioxo-1,5-benzodioxepin-7-yl)propanoic acid Traditional Name: 3-(2,4-diketo-1,5-benzodioxepin-7-yl)propionic acid Formula: C12H10O6 MolecularWeight: 250.2042

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)OC2=C(C=C(C=C2)CCC(=O)O)OC1=O

Isomeric SMILES

C1C(=O)OC2=C(C=C(C=C2)CCC(=O)O)OC1=O

InChI

InChI=1S/C12H10O6/c13-10(14)4-2-7-1-3-8-9(5-7)18-12(16)6-11(15)17-8/h1,3,5H,2,4,6H2,(H,13,14)