5-(cyclohexen-1-ylmethyl)-6-[2-(dioxidanyl)ethanoyl]-4-oxidanyl-1-benzofuran-3-one

Systemtic Name: 5-(cyclohexen-1-ylmethyl)-6-[2-(dioxidanyl)ethanoyl]-4-oxidanyl-1-benzofuran-3-one Openeye Name: 5-(cyclohexen-1-ylmethyl)-6-(2-hydroperoxyacetyl)-4-hydroxy-benzofuran-3-one CAS Name: 5-(1-cyclohexenylmethyl)-6-(2-hydroperoxy-1-oxoethyl)-4-hydroxy-3-benzofuranone IUPAC Name: 5-(cyclohexen-1-ylmethyl)-6-(2-hydroperoxyacetyl)-4-hydroxy-1-benzofuran-3-one Traditional Name: 5-(cyclohexen-1-ylmethyl)-6-(2-hydroperoxyacetyl)-4-hydroxy-coumaran-3-one Formula: C17H18O6 MolecularWeight: 318.32122

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CC2=C(C3=C(C=C2C(=O)COO)OCC3=O)O

Isomeric SMILES

C1CCC(=CC1)CC2=C(C3=C(C=C2C(=O)COO)OCC3=O)O

InChI

InChI=1S/C17H18O6/c18-13(9-23-21)11-7-15-16(14(19)8-22-15)17(20)12(11)6-10-4-2-1-3-5-10/h4,7,20-21H,1-3,5-6,8-9H2