3-[[3-(dioxidanylmethyl)-5-methyl-2-oxidanyl-phenyl]methyl]-5-methyl-2-oxidanyl-benzoic acid

Systemtic Name: 3-[[3-(dioxidanylmethyl)-5-methyl-2-oxidanyl-phenyl]methyl]-5-methyl-2-oxidanyl-benzoic acid Openeye Name: 3-[[3-(hydroperoxymethyl)-2-hydroxy-5-methyl-phenyl]methyl]-2-hydroxy-5-methyl-benzoic acid CAS Name: 3-[[3-(hydroperoxymethyl)-2-hydroxy-5-methylphenyl]methyl]-2-hydroxy-5-methylbenzoic acid IUPAC Name: 3-[[3-(hydroperoxymethyl)-2-hydroxy-5-methylphenyl]methyl]-2-hydroxy-5-methylbenzoic acid Traditional Name: 3-[3-(hydroperoxymethyl)-2-hydroxy-5-methyl-benzyl]-2-hydroxy-5-methyl-benzoic acid Formula: C17H18O6 MolecularWeight: 318.32122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)COO)O)CC2=C(C(=CC(=C2)C)C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)COO)O)CC2=C(C(=CC(=C2)C)C(=O)O)O

InChI

InChI=1S/C17H18O6/c1-9-3-11(15(18)13(5-9)8-23-22)7-12-4-10(2)6-14(16(12)19)17(20)21/h3-6,18-19,22H,7-8H2,1-2H3,(H,20,21)