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

Systemtic Name: 5-methyl-2-oxidanyl-benzoic acid; zirconium Openeye Name: 2-hydroxy-5-methyl-benzoic acid; zirconium CAS Name: 2-hydroxy-5-methylbenzoic acid; zirconium IUPAC Name: 2-hydroxy-5-methylbenzoic acid; zirconium Traditional Name: 2-hydroxy-5-methyl-benzoic acid; zirconium Formula: C16H16O6Zr MolecularWeight: 395.51864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C8H8O3.Zr/c2*1-5-2-3-7(9)6(4-5)8(10)11;/h2*2-4,9H,1H3,(H,10,11);