9-methyl-8-oxidanyl-7-(phenylmethyl)-1,5-dioxonane-2,6-dione

Systemtic Name: 9-methyl-8-oxidanyl-7-(phenylmethyl)-1,5-dioxonane-2,6-dione Openeye Name: 7-benzyl-8-hydroxy-9-methyl-1,5-dioxonane-2,6-dione CAS Name: 8-hydroxy-9-methyl-7-(phenylmethyl)-1,5-dioxonane-2,6-dione IUPAC Name: 7-benzyl-8-hydroxy-9-methyl-1,5-dioxonane-2,6-dione Traditional Name: 7-benzyl-8-hydroxy-9-methyl-1,5-dioxonane-2,6-quinone Formula: C15H18O5 MolecularWeight: 278.30042

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(=O)OCCC(=O)O1)CC2=CC=CC=C2)O

Isomeric SMILES

CC1C(C(C(=O)OCCC(=O)O1)CC2=CC=CC=C2)O

InChI

InChI=1S/C15H18O5/c1-10-14(17)12(9-11-5-3-2-4-6-11)15(18)19-8-7-13(16)20-10/h2-6,10,12,14,17H,7-9H2,1H3