3,4-bis(oxidanyl)benzoic acid; 4-(dioxidanylmethyl)benzene-1,2-diol; zirconium

Systemtic Name: 3,4-bis(oxidanyl)benzoic acid; 4-(dioxidanylmethyl)benzene-1,2-diol; zirconium Openeye Name: 3,4-dihydroxybenzoic acid; 4-(hydroperoxymethyl)benzene-1,2-diol; zirconium CAS Name: 3,4-dihydroxybenzoic acid; 4-(hydroperoxymethyl)benzene-1,2-diol; zirconium IUPAC Name: 3,4-dihydroxybenzoic acid; 4-(hydroperoxymethyl)benzene-1,2-diol; zirconium Traditional Name: 4-(hydroperoxymethyl)pyrocatechol; protocatechuic acid; zirconium Formula: C14H14O8Zr MolecularWeight: 401.48016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1COO)O)O.C1=CC(=C(C=C1C(=O)O)O)O.[Zr]

Isomeric SMILES

C1=CC(=C(C=C1COO)O)O.C1=CC(=C(C=C1C(=O)O)O)O.[Zr]

InChI

InChI=1S/C7H8O4.C7H6O4.Zr/c8-6-2-1-5(4-11-10)3-7(6)9;8-5-2-1-4(7(10)11)3-6(5)9;/h1-3,8-10H,4H2;1-3,8-9H,(H,10,11);