5-methyl-2-oxidanyl-benzoic acid; 5-octyl-2-oxidanyl-benzoic acid; zirconium

Systemtic Name: 5-methyl-2-oxidanyl-benzoic acid; 5-octyl-2-oxidanyl-benzoic acid; zirconium Openeye Name: 2-hydroxy-5-methyl-benzoic acid; 2-hydroxy-5-octyl-benzoic acid; zirconium CAS Name: 2-hydroxy-5-methylbenzoic acid; 2-hydroxy-5-octylbenzoic acid; zirconium IUPAC Name: 2-hydroxy-5-methylbenzoic acid; 2-hydroxy-5-octylbenzoic acid; zirconium Traditional Name: 2-hydroxy-5-methyl-benzoic acid; 2-hydroxy-5-octyl-benzoic acid; zirconium Formula: C23H30O6Zr MolecularWeight: 493.7047

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)O)C(=O)O.CC1=CC(=C(C=C1)O)C(=O)O.[Zr]

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)O)C(=O)O.CC1=CC(=C(C=C1)O)C(=O)O.[Zr]

InChI

InChI=1S/C15H22O3.C8H8O3.Zr/c1-2-3-4-5-6-7-8-12-9-10-14(16)13(11-12)15(17)18;1-5-2-3-7(9)6(4-5)8(10)11;/h9-11,16H,2-8H2,1H3,(H,17,18);2-4,9H,1H3,(H,10,11);